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

Systemtic Name: methyl 3-[(6-methoxypyridin-3-yl)methylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(6-methoxy-3-pyridyl)methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[(6-methoxy-3-pyridinyl)methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(6-methoxypyridin-3-yl)methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(6-methoxy-3-pyridyl)methylcarbamoyl]-5-nitro-benzoic acid methyl ester Formula: C16H15N3O6 MolecularWeight: 345.3068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O6/c1-24-14-4-3-10(8-17-14)9-18-15(20)11-5-12(16(21)25-2)7-13(6-11)19(22)23/h3-8H,9H2,1-2H3,(H,18,20)