(2Z)-2-[(E)-3-(1-butyl-3,3-dimethyl-indol-1-ium-2-yl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitro-indole

Systemtic Name: (2Z)-2-[(E)-3-(1-butyl-3,3-dimethyl-indol-1-ium-2-yl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitro-indole Openeye Name: (2Z)-2-[(E)-3-(1-butyl-3,3-dimethyl-indol-1-ium-2-yl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitro-indoline CAS Name: (2Z)-2-[(E)-3-(1-butyl-3,3-dimethyl-2-indol-1-iumyl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitroindole IUPAC Name: (2Z)-2-[(E)-3-(1-butyl-3,3-dimethylindol-1-ium-2-yl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitroindole Traditional Name: (2Z)-2-[(E)-3-(1-butyl-3,3-dimethyl-indol-1-ium-2-yl)prop-2-enylidene]-1-ethyl-3,3-dimethyl-5-nitro-indoline Formula: C29H36N3O2+ MolecularWeight: 458.61504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C(C2=CC=CC=C21)(C)C)C=CC=C3C(C4=C(N3CC)C=CC(=C4)[N+](=O)[O-])(C)C

Isomeric SMILES

CCCC[N+]1=C(C(C2=CC=CC=C21)(C)C)/C=C/C=C\3/C(C4=C(N3CC)C=CC(=C4)[N+](=O)[O-])(C)C

InChI

InChI=1S/C29H36N3O2/c1-7-9-19-31-24-14-11-10-13-22(24)28(3,4)27(31)16-12-15-26-29(5,6)23-20-21(32(33)34)17-18-25(23)30(26)8-2/h10-18,20H,7-9,19H2,1-6H3/q+1