2-nitro-1-[2-[(phenylmethyl)amino]pyridin-3-yl]ethanone

Systemtic Name: 2-nitro-1-[2-[(phenylmethyl)amino]pyridin-3-yl]ethanone Openeye Name: 1-[2-(benzylamino)-3-pyridyl]-2-nitro-ethanone CAS Name: 2-nitro-1-[2-[(phenylmethyl)amino]-3-pyridinyl]ethanone IUPAC Name: 1-[2-(benzylamino)pyridin-3-yl]-2-nitroethanone Traditional Name: 1-[2-(benzylamino)-3-pyridyl]-2-nitro-ethanone Formula: C14H13N3O3 MolecularWeight: 271.27132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=CC=N2)C(=O)C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=CC=N2)C(=O)C[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O3/c18-13(10-17(19)20)12-7-4-8-15-14(12)16-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)