2-(3,4-dimethoxyphenyl)ethyl-[(2R)-1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R)-2-(2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: homoveratryl-[(1R)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-methyl-ethyl]-methyl-ammonium Formula: C22H31N2O4+ MolecularWeight: 387.49254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)[NH+](C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@@H](C)[NH+](C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H30N2O4/c1-15-7-9-19(26-4)18(13-15)23-22(25)16(2)24(3)12-11-17-8-10-20(27-5)21(14-17)28-6/h7-10,13-14,16H,11-12H2,1-6H3,(H,23,25)/p+1/t16-/m1/s1