1-(2,4-dinitrophenyl)-4-[(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(2,4-dinitrophenyl)-4-[(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-(2,4-dinitrophenyl)-4-(p-tolylmethyl)-1,4-diazepane CAS Name: 1-(2,4-dinitrophenyl)-4-[(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(2,4-dinitrophenyl)-4-[(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-(2,4-dinitrophenyl)-4-(4-methylbenzyl)-1,4-diazepane Formula: C19H22N4O4 MolecularWeight: 370.40238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-15-3-5-16(6-4-15)14-20-9-2-10-21(12-11-20)18-8-7-17(22(24)25)13-19(18)23(26)27/h3-8,13H,2,9-12,14H2,1H3