methyl 3-nitro-5-(2-pyridin-3-ylethylcarbamoyl)benzoate

Systemtic Name: methyl 3-nitro-5-(2-pyridin-3-ylethylcarbamoyl)benzoate Openeye Name: methyl 3-nitro-5-[2-(3-pyridyl)ethylcarbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[2-(3-pyridinyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-(2-pyridin-3-ylethylcarbamoyl)benzoate Traditional Name: 3-nitro-5-[2-(3-pyridyl)ethylcarbamoyl]benzoic acid methyl ester Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5/c1-24-16(21)13-7-12(8-14(9-13)19(22)23)15(20)18-6-4-11-3-2-5-17-10-11/h2-3,5,7-10H,4,6H2,1H3,(H,18,20)