heptyl-dimethyl-[[1-(phenylmethyl)indol-3-yl]methyl]azanium

Systemtic Name: heptyl-dimethyl-[[1-(phenylmethyl)indol-3-yl]methyl]azanium Openeye Name: (1-benzylindol-3-yl)methyl-heptyl-dimethyl-ammonium CAS Name: heptyl-dimethyl-[[1-(phenylmethyl)-3-indolyl]methyl]ammonium IUPAC Name: (1-benzylindol-3-yl)methyl-heptyl-dimethylazanium Traditional Name: (1-benzylindol-3-yl)methyl-heptyl-dimethyl-ammonium Formula: C25H35N2+ MolecularWeight: 363.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](C)(C)CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCC[N+](C)(C)CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C25H35N2/c1-4-5-6-7-13-18-27(2,3)21-23-20-26(19-22-14-9-8-10-15-22)25-17-12-11-16-24(23)25/h8-12,14-17,20H,4-7,13,18-19,21H2,1-3H3/q+1