methyl 4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]benzoate

Systemtic Name: methyl 4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]benzoate Openeye Name: methyl 4-[(5-nitro-2-oxo-1-pyridyl)methyl]benzoate CAS Name: 4-[(5-nitro-2-oxo-1-pyridinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-nitro-2-oxopyridin-1-yl)methyl]benzoate Traditional Name: 4-[(2-keto-5-nitro-1-pyridyl)methyl]benzoic acid methyl ester Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5/c1-21-14(18)11-4-2-10(3-5-11)8-15-9-12(16(19)20)6-7-13(15)17/h2-7,9H,8H2,1H3