methyl 3-[(5-chloranylpyridin-2-yl)carbamoyl]-4-nitro-benzoate

Systemtic Name: methyl 3-[(5-chloranylpyridin-2-yl)carbamoyl]-4-nitro-benzoate Openeye Name: methyl 3-[(5-chloro-2-pyridyl)carbamoyl]-4-nitro-benzoate CAS Name: 3-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(5-chloropyridin-2-yl)carbamoyl]-4-nitrobenzoate Traditional Name: 3-[(5-chloro-2-pyridyl)carbamoyl]-4-nitro-benzoic acid methyl ester Formula: C14H10ClN3O5 MolecularWeight: 335.6993

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C14H10ClN3O5/c1-23-14(20)8-2-4-11(18(21)22)10(6-8)13(19)17-12-5-3-9(15)7-16-12/h2-7H,1H3,(H,16,17,19)