(phenylmethyl) 3-(4-nitrophenyl)-2-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) 3-(4-nitrophenyl)-2-oxidanylidene-propanoate Openeye Name: benzyl 3-(4-nitrophenyl)-2-oxo-propanoate CAS Name: 3-(4-nitrophenyl)-2-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-nitrophenyl)-2-oxopropanoate Traditional Name: 2-keto-3-(4-nitrophenyl)propionic acid benzyl ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5/c18-15(10-12-6-8-14(9-7-12)17(20)21)16(19)22-11-13-4-2-1-3-5-13/h1-9H,10-11H2