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

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium Traditional Name: [(1R)-2-anilino-2-keto-1-methyl-ethyl]-homoveratryl-methyl-ammonium Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH+](C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H26N2O3/c1-15(20(23)21-17-8-6-5-7-9-17)22(2)13-12-16-10-11-18(24-3)19(14-16)25-4/h5-11,14-15H,12-13H2,1-4H3,(H,21,23)/p+1/t15-/m1/s1