2-[(2E,4E)-3-methyl-6-(1-methyl-2,3-dihydroindol-2-yl)hexa-2,4-dien-2-yl]-1-propan-2-yl-3H-indol-1-ium

Systemtic Name: 2-[(2E,4E)-3-methyl-6-(1-methyl-2,3-dihydroindol-2-yl)hexa-2,4-dien-2-yl]-1-propan-2-yl-3H-indol-1-ium Openeye Name: 2-[(1E,3E)-1,2-dimethyl-5-(1-methylindolin-2-yl)penta-1,3-dienyl]-1-isopropyl-3H-indol-1-ium CAS Name: 2-[(2E,4E)-3-methyl-6-(1-methyl-2,3-dihydroindol-2-yl)hexa-2,4-dien-2-yl]-1-propan-2-yl-3H-indol-1-ium IUPAC Name: 2-[(2E,4E)-3-methyl-6-(1-methyl-2,3-dihydroindol-2-yl)hexa-2,4-dien-2-yl]-1-propan-2-yl-3H-indol-1-ium Traditional Name: 2-[(1E,3E)-1,2-dimethyl-5-(1-methylindolin-2-yl)penta-1,3-dienyl]-1-isopropyl-3H-indol-1-ium Formula: C27H33N2+ MolecularWeight: 385.56432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(CC2=CC=CC=C21)C(=C(C)C=CCC3CC4=CC=CC=C4N3C)C

Isomeric SMILES

CC(C)[N+]1=C(CC2=CC=CC=C21)/C(=C(\C)/C=C/CC3CC4=CC=CC=C4N3C)/C

InChI

InChI=1S/C27H33N2/c1-19(2)29-26-16-9-7-13-23(26)18-27(29)21(4)20(3)11-10-14-24-17-22-12-6-8-15-25(22)28(24)5/h6-13,15-16,19,24H,14,17-18H2,1-5H3/q+1/b11-10+,21-20+