(2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethyl-indole

Systemtic Name: (2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethyl-indole Openeye Name: (2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethyl-indoline CAS Name: (2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethylindole IUPAC Name: (2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethylindole Traditional Name: (2Z)-2-[3,3-bis(5-methyl-1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)prop-2-enylidene]-1,3,3-trimethyl-indoline Formula: C44H41N7+2 MolecularWeight: 667.84324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=NN1C2=CC=CC=C2)C(=CC=C3C(C4=CC=CC=C4N3C)(C)C)C5=NN(C(=[N+]5C6=CC=CC=C6)C)C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CC1=[N+](C(=NN1C2=CC=CC=C2)C(=C/C=C\3/C(C4=CC=CC=C4N3C)(C)C)C5=NN(C(=[N+]5C6=CC=CC=C6)C)C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C44H41N7/c1-32-48(34-20-10-6-11-21-34)42(45-50(32)36-24-14-8-15-25-36)38(30-31-41-44(3,4)39-28-18-19-29-40(39)47(41)5)43-46-51(37-26-16-9-17-27-37)33(2)49(43)35-22-12-7-13-23-35/h6-31H,1-5H3/q+2/b41-31-