methyl 3-[(6-methoxypyridin-3-yl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(6-methoxypyridin-3-yl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(6-methoxy-3-pyridyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(6-methoxy-3-pyridinyl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(6-methoxypyridin-3-yl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(6-methoxy-3-pyridyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H13N3O6/c1-23-13-4-3-11(8-16-13)17-14(19)9-5-10(15(20)24-2)7-12(6-9)18(21)22/h3-8H,1-2H3,(H,17,19)