N-(3-imidazol-1-ylpropyl)-3-methyl-2-nitro-benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-methyl-2-nitro-benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-3-methyl-2-nitro-benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-3-methyl-2-nitrobenzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-3-methyl-2-nitro-benzamide Formula: C14H16N4O3 MolecularWeight: 288.30184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCCCN2C=CN=C2

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCCCN2C=CN=C2

InChI

InChI=1S/C14H16N4O3/c1-11-4-2-5-12(13(11)18(20)21)14(19)16-6-3-8-17-9-7-15-10-17/h2,4-5,7,9-10H,3,6,8H2,1H3,(H,16,19)