2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]azanium Traditional Name: homoveratryl-[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]-methyl-ammonium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+](C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+](C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H26N2O3/c1-15-22(17-7-5-6-8-18(17)23-15)19(25)14-24(2)12-11-16-9-10-20(26-3)21(13-16)27-4/h5-10,13,23H,11-12,14H2,1-4H3/p+1