methyl 3-nitro-5-(pyridin-4-ylmethylcarbamoyl)benzoate

Systemtic Name: methyl 3-nitro-5-(pyridin-4-ylmethylcarbamoyl)benzoate Openeye Name: methyl 3-nitro-5-(4-pyridylmethylcarbamoyl)benzoate CAS Name: 3-nitro-5-[oxo-(pyridin-4-ylmethylamino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-(pyridin-4-ylmethylcarbamoyl)benzoate Traditional Name: 3-nitro-5-(4-pyridylmethylcarbamoyl)benzoic acid methyl ester Formula: C15H13N3O5 MolecularWeight: 315.28082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O5/c1-23-15(20)12-6-11(7-13(8-12)18(21)22)14(19)17-9-10-2-4-16-5-3-10/h2-8H,9H2,1H3,(H,17,19)