4-[(E)-2-(1-butyl-3,3,5-trimethyl-indol-1-ium-2-yl)ethenyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(E)-2-(1-butyl-3,3,5-trimethyl-indol-1-ium-2-yl)ethenyl]-N,N-dimethyl-aniline Openeye Name: 4-[(E)-2-(1-butyl-3,3,5-trimethyl-indol-1-ium-2-yl)vinyl]-N,N-dimethyl-aniline CAS Name: 4-[(E)-2-(1-butyl-3,3,5-trimethyl-2-indol-1-iumyl)ethenyl]-N,N-dimethylaniline IUPAC Name: 4-[(E)-2-(1-butyl-3,3,5-trimethylindol-1-ium-2-yl)ethenyl]-N,N-dimethylaniline Traditional Name: [4-[(E)-2-(1-butyl-3,3,5-trimethyl-indol-1-ium-2-yl)vinyl]phenyl]-dimethyl-amine Formula: C25H33N2+ MolecularWeight: 361.54292

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C(C2=C1C=CC(=C2)C)(C)C)C=CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCCC[N+]1=C(C(C2=C1C=CC(=C2)C)(C)C)/C=C/C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C25H33N2/c1-7-8-17-27-23-15-9-19(2)18-22(23)25(3,4)24(27)16-12-20-10-13-21(14-11-20)26(5)6/h9-16,18H,7-8,17H2,1-6H3/q+1