[(2S)-3-methoxy-2-[(3-methylphenyl)carbonylamino]-3-oxidanylidene-propyl] 3-methylbenzoate

Systemtic Name: [(2S)-3-methoxy-2-[(3-methylphenyl)carbonylamino]-3-oxidanylidene-propyl] 3-methylbenzoate Openeye Name: [(2S)-3-methoxy-2-[(3-methylbenzoyl)amino]-3-oxo-propyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [(2S)-3-methoxy-2-[[(3-methylphenyl)-oxomethyl]amino]-3-oxopropyl] ester IUPAC Name: [(2S)-3-methoxy-2-[(3-methylbenzoyl)amino]-3-oxopropyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [(2S)-3-keto-3-methoxy-2-(m-toluoylamino)propyl] ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(COC(=O)C2=CC(=CC=C2)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](COC(=O)C2=CC(=CC=C2)C)C(=O)OC

InChI

InChI=1S/C20H21NO5/c1-13-6-4-8-15(10-13)18(22)21-17(20(24)25-3)12-26-19(23)16-9-5-7-14(2)11-16/h4-11,17H,12H2,1-3H3,(H,21,22)/t17-/m0/s1