(3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(p-tolylmethylamino)ethyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-[(4-methylbenzyl)amino]ethyl]-methyl-veratryl-ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)[NH+](C)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@@H](C)[NH+](C)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28N2O3/c1-15-6-8-17(9-7-15)13-22-21(24)16(2)23(3)14-18-10-11-19(25-4)20(12-18)26-5/h6-12,16H,13-14H2,1-5H3,(H,22,24)/p+1/t16-/m1/s1