[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-keto-2-[(1-methylpyrrole-2-carbonyl)amino]ethyl] ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NC(=O)C1=CC=CN1C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NC(=O)C1=CC=CN1C)C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4/c1-13(14-7-4-3-5-8-14)11-17(22)24-12-16(21)19-18(23)15-9-6-10-20(15)2/h3-10,13H,11-12H2,1-2H3,(H,19,21,23)/t13-/m1/s1