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

Systemtic Name: [(1S)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-(homoveratrylamino)-2-keto-1-phenyl-ethyl]ammonium Formula: C18H23N2O3+ MolecularWeight: 315.38682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3/c1-22-15-9-8-13(12-16(15)23-2)10-11-20-18(21)17(19)14-6-4-3-5-7-14/h3-9,12,17H,10-11,19H2,1-2H3,(H,20,21)/p+1/t17-/m0/s1