(phenylmethyl) 4-[(5-nitropyridin-2-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(5-nitropyridin-2-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(5-nitro-2-pyridyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(5-nitro-2-pyridinyl)amino]-oxomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(5-nitropyridin-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(5-nitro-2-pyridyl)carbamoyl]piperidine-1-carboxylic acid benzyl ester Formula: C19H20N4O5 MolecularWeight: 384.3859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O5/c24-18(21-17-7-6-16(12-20-17)23(26)27)15-8-10-22(11-9-15)19(25)28-13-14-4-2-1-3-5-14/h1-7,12,15H,8-11,13H2,(H,20,21,24)