(4Z)-4-(1,2-dimethyl-5-phenyl-indol-1-ium-3-ylidene)-2-(1,2-dimethyl-5-phenyl-indol-3-yl)-3-oxidanyl-cyclobut-2-en-1-one

Systemtic Name: (4Z)-4-(1,2-dimethyl-5-phenyl-indol-1-ium-3-ylidene)-2-(1,2-dimethyl-5-phenyl-indol-3-yl)-3-oxidanyl-cyclobut-2-en-1-one Openeye Name: (4Z)-4-(1,2-dimethyl-5-phenyl-indol-1-ium-3-ylidene)-2-(1,2-dimethyl-5-phenyl-indol-3-yl)-3-hydroxy-cyclobut-2-en-1-one CAS Name: (4Z)-4-(1,2-dimethyl-5-phenyl-3-indol-1-iumylidene)-2-(1,2-dimethyl-5-phenyl-3-indolyl)-3-hydroxy-1-cyclobut-2-enone IUPAC Name: (4Z)-4-(1,2-dimethyl-5-phenylindol-1-ium-3-ylidene)-2-(1,2-dimethyl-5-phenylindol-3-yl)-3-hydroxycyclobut-2-en-1-one Traditional Name: (4Z)-4-(1,2-dimethyl-5-phenyl-indol-1-ium-3-ylidene)-2-(1,2-dimethyl-5-phenyl-indol-3-yl)-3-hydroxy-cyclobut-2-en-1-one Formula: C36H29N2O2+ MolecularWeight: 521.62766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)C3=CC=CC=C3)C4=C(C(=C5C(=[N+](C6=C5C=C(C=C6)C7=CC=CC=C7)C)C)C4=O)O

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)C3=CC=CC=C3)C4=C(/C(=C\5/C(=[N+](C6=C5C=C(C=C6)C7=CC=CC=C7)C)C)/C4=O)O

InChI

InChI=1S/C36H28N2O2/c1-21-31(27-19-25(15-17-29(27)37(21)3)23-11-7-5-8-12-23)33-35(39)34(36(33)40)32-22(2)38(4)30-18-16-26(20-28(30)32)24-13-9-6-10-14-24/h5-20H,1-4H3/p+1