[(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: [(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-keto-1-phenyl-2-(veratrylamino)ethyl]ammonium Formula: C17H21N2O3+ MolecularWeight: 301.36024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(C2=CC=CC=C2)[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)[C@H](C2=CC=CC=C2)[NH3+])OC

InChI

InChI=1S/C17H20N2O3/c1-21-14-9-8-12(10-15(14)22-2)11-19-17(20)16(18)13-6-4-3-5-7-13/h3-10,16H,11,18H2,1-2H3,(H,19,20)/p+1/t16-/m0/s1