[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)OC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H27NO6/c1-23(2)22(25)20(16-9-7-6-8-10-16)29-19(24)12-11-15-13-17(26-3)21(28-5)18(14-15)27-4/h6-10,13-14,20H,11-12H2,1-5H3/t20-/m0/s1