[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]propanoyl]cyclopent-3-en-1-ylidene]methylidene]cyclopentene-1-carboxylate

Systemtic Name: [4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]propanoyl]cyclopent-3-en-1-ylidene]methylidene]cyclopentene-1-carboxylate Openeye Name: [4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]propanoyl]cyclopent-3-en-1-ylidene]methylene]cyclopentene-1-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]-1-oxopropyl]-1-cyclopent-3-enylidene]methylidene]-1-cyclopentenecarboxylic acid [4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl ester IUPAC Name: [4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]propanoyl]cyclopent-3-en-1-ylidene]methylidene]cyclopentene-1-carboxylate Traditional Name: 2-methyl-4-[[3-methyl-4-[3-[4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]propanoyl]cyclopent-3-en-1-ylidene]methylene]cyclopentene-1-carboxylic acid [4-[[2-[(1-methyl-3H-indol-1-ium-2-yl)methyl]-3H-indol-1-ium-1-yl]methyl]benzyl] ester Formula: C68H66N4O3+4 MolecularWeight: 987.27664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C=C2CC(=C(C2)C(=O)OCC3=CC=C(C=C3)C[N+]4=C(CC5=CC=CC=C54)CC6=[N+](C7=CC=CC=C7C6)C)C)C1)C(=O)CCC8=CC=C(C=C8)C[N+]9=C(CC1=CC=CC=C19)CC1=[N+](C2=CC=CC=C2C1)C

Isomeric SMILES

CC1=C(CC(=C=C2CC(=C(C2)C(=O)OCC3=CC=C(C=C3)C[N+]4=C(CC5=CC=CC=C54)CC6=[N+](C7=CC=CC=C7C6)C)C)C1)C(=O)CCC8=CC=C(C=C8)C[N+]9=C(CC1=CC=CC=C19)CC1=[N+](C2=CC=CC=C2C1)C

InChI

InChI=1S/C68H66N4O3/c1-45-31-51(34-61(45)67(73)30-29-47-21-23-48(24-22-47)42-71-59(38-55-15-7-11-19-65(55)71)40-57-36-53-13-5-9-17-63(53)69(57)3)33-52-32-46(2)62(35-52)68(74)75-44-50-27-25-49(26-28-50)43-72-60(39-56-16-8-12-20-66(56)72)41-58-37-54-14-6-10-18-64(54)70(58)4/h5-28H,29-32,34-44H2,1-4H3/q+4