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

Systemtic Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-(veratrylamino)ethyl]ammonium Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(CC2=CC=CC=C2)[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)[C@H](CC2=CC=CC=C2)[NH3+])OC

InChI

InChI=1S/C18H22N2O3/c1-22-16-9-8-14(11-17(16)23-2)12-20-18(21)15(19)10-13-6-4-3-5-7-13/h3-9,11,15H,10,12,19H2,1-2H3,(H,20,21)/p+1/t15-/m0/s1