(6-methyl-2-nitro-pyridin-3-yl) 6-(chloromethyl)-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (6-methyl-2-nitro-pyridin-3-yl) 6-(chloromethyl)-2-oxidanylidene-chromene-3-carboxylate Openeye Name: (6-methyl-2-nitro-3-pyridyl) 6-(chloromethyl)-2-oxo-chromene-3-carboxylate CAS Name: 6-(chloromethyl)-2-oxo-1-benzopyran-3-carboxylic acid (6-methyl-2-nitro-3-pyridinyl) ester IUPAC Name: (6-methyl-2-nitropyridin-3-yl) 6-(chloromethyl)-2-oxochromene-3-carboxylate Traditional Name: 6-(chloromethyl)-2-keto-chromene-3-carboxylic acid (6-methyl-2-nitro-3-pyridyl) ester Formula: C17H11ClN2O6 MolecularWeight: 374.73204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OC(=O)C2=CC3=C(C=CC(=C3)CCl)OC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OC(=O)C2=CC3=C(C=CC(=C3)CCl)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H11ClN2O6/c1-9-2-4-14(15(19-9)20(23)24)26-17(22)12-7-11-6-10(8-18)3-5-13(11)25-16(12)21/h2-7H,8H2,1H3