[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,4-dimethoxybenzoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,4-dimethoxybenzoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H21NO5 MolecularWeight: 355.38444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3CC3)OC

InChI

InChI=1S/C20H21NO5/c1-24-15-10-11-16(17(12-15)25-2)20(23)26-18(13-6-4-3-5-7-13)19(22)21-14-8-9-14/h3-7,10-12,14,18H,8-9H2,1-2H3,(H,21,22)/t18-/m1/s1