methyl 3-[(3-nitrophenyl)carbonylamino]-4-oxidanylidene-pentanoate

Systemtic Name: methyl 3-[(3-nitrophenyl)carbonylamino]-4-oxidanylidene-pentanoate Openeye Name: methyl 3-[(3-nitrobenzoyl)amino]-4-oxo-pentanoate CAS Name: 3-[[(3-nitrophenyl)-oxomethyl]amino]-4-oxopentanoic acid methyl ester IUPAC Name: methyl 3-[(3-nitrobenzoyl)amino]-4-oxopentanoate Traditional Name: 4-keto-3-[(3-nitrobenzoyl)amino]valeric acid methyl ester Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(=O)OC)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(CC(=O)OC)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c1-8(16)11(7-12(17)21-2)14-13(18)9-4-3-5-10(6-9)15(19)20/h3-6,11H,7H2,1-2H3,(H,14,18)