methyl 1-[(4-chlorophenyl)methyl]-5-nitro-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[(4-chlorophenyl)methyl]-5-nitro-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[(4-chlorophenyl)methyl]-5-nitro-6-oxo-pyridine-3-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-5-nitro-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-chlorophenyl)methyl]-5-nitro-6-oxopyridine-3-carboxylate Traditional Name: 1-(4-chlorobenzyl)-6-keto-5-nitro-nicotinic acid methyl ester Formula: C14H11ClN2O5 MolecularWeight: 322.70054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN2O5/c1-22-14(19)10-6-12(17(20)21)13(18)16(8-10)7-9-2-4-11(15)5-3-9/h2-6,8H,7H2,1H3