[2-(5-nitro-2-oxidanylidene-pyridin-1-yl)-3-oxidanyl-propyl] 4-chloranylbenzoate

Systemtic Name: [2-(5-nitro-2-oxidanylidene-pyridin-1-yl)-3-oxidanyl-propyl] 4-chloranylbenzoate Openeye Name: [3-hydroxy-2-(5-nitro-2-oxo-1-pyridyl)propyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [3-hydroxy-2-(5-nitro-2-oxo-1-pyridinyl)propyl] ester IUPAC Name: [3-hydroxy-2-(5-nitro-2-oxopyridin-1-yl)propyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [3-hydroxy-2-(2-keto-5-nitro-1-pyridyl)propyl] ester Formula: C15H13ClN2O6 MolecularWeight: 352.72652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(CO)N2C=C(C=CC2=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(CO)N2C=C(C=CC2=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN2O6/c16-11-3-1-10(2-4-11)15(21)24-9-13(8-19)17-7-12(18(22)23)5-6-14(17)20/h1-7,13,19H,8-9H2