N-[(E)-2-(3,3-dimethyl-1-propyl-benzo[e]indol-3-ium-2-yl)ethenyl]aniline

Systemtic Name: N-[(E)-2-(3,3-dimethyl-1-propyl-benzo[e]indol-3-ium-2-yl)ethenyl]aniline Openeye Name: N-[(E)-2-(3,3-dimethyl-1-propyl-benzo[e]indol-3-ium-2-yl)vinyl]aniline CAS Name: N-[(E)-2-(3,3-dimethyl-1-propyl-2-benzo[e]indol-3-iumyl)ethenyl]aniline IUPAC Name: N-[(E)-2-(3,3-dimethyl-1-propylbenzo[e]indol-3-ium-2-yl)ethenyl]aniline Traditional Name: [(E)-2-(3,3-dimethyl-1-propyl-benz[e]indol-3-ium-2-yl)vinyl]-phenyl-amine Formula: C25H27N2+ MolecularWeight: 355.49528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+](C2=C1C3=CC=CC=C3C=C2)(C)C)C=CNC4=CC=CC=C4

Isomeric SMILES

CCCC1=C([N+](C2=C1C3=CC=CC=C3C=C2)(C)C)/C=C/NC4=CC=CC=C4

InChI

InChI=1S/C25H27N2/c1-4-10-22-23(17-18-26-20-12-6-5-7-13-20)27(2,3)24-16-15-19-11-8-9-14-21(19)25(22)24/h5-9,11-18,26H,4,10H2,1-3H3/q+1/b18-17+