2-(3,4-dimethoxyphenyl)ethyl-[2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(2-acetylanilino)-2-oxo-ethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-ammonium CAS Name: [2-(2-acetylanilino)-2-oxoethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylammonium IUPAC Name: [2-(2-acetylanilino)-2-oxoethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium Traditional Name: [2-(2-acetylanilino)-2-keto-ethyl]-homoveratryl-methyl-ammonium Formula: C21H27N2O4+ MolecularWeight: 371.45008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H26N2O4/c1-15(24)17-7-5-6-8-18(17)22-21(25)14-23(2)12-11-16-9-10-19(26-3)20(13-16)27-4/h5-10,13H,11-12,14H2,1-4H3,(H,22,25)/p+1