[2-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 3-nitrobenzoate

Systemtic Name: [2-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 3-nitrobenzoate Openeye Name: [2-(2-methoxy-2-oxo-ethyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [2-(2-methoxy-2-oxoethyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=CC=C1OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CC=CC=C1OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO6/c1-22-15(18)10-11-5-2-3-8-14(11)23-16(19)12-6-4-7-13(9-12)17(20)21/h2-9H,10H2,1H3