(phenylmethyl) N-[(5-nitropyridin-3-yl)methyl]carbamate

Systemtic Name: (phenylmethyl) N-[(5-nitropyridin-3-yl)methyl]carbamate Openeye Name: benzyl N-[(5-nitro-3-pyridyl)methyl]carbamate CAS Name: N-[(5-nitro-3-pyridinyl)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(5-nitropyridin-3-yl)methyl]carbamate Traditional Name: N-[(5-nitro-3-pyridyl)methyl]carbamic acid benzyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O4/c18-14(21-10-11-4-2-1-3-5-11)16-8-12-6-13(17(19)20)9-15-7-12/h1-7,9H,8,10H2,(H,16,18)