1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(3-methylphenyl)methyl]piperazine

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(3-methylphenyl)methyl]piperazine Openeye Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(m-tolylmethyl)piperazine CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-4-[(3-methylphenyl)methyl]piperazine IUPAC Name: 1-(3-methyl-5-nitroimidazol-4-yl)-4-[(3-methylphenyl)methyl]piperazine Traditional Name: 1-(3-methylbenzyl)-4-(3-methyl-5-nitro-imidazol-4-yl)piperazine Formula: C16H21N5O2 MolecularWeight: 315.37024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O2/c1-13-4-3-5-14(10-13)11-19-6-8-20(9-7-19)16-15(21(22)23)17-12-18(16)2/h3-5,10,12H,6-9,11H2,1-2H3