3-(4-methyl-2-nitro-phenyl)-1,1-bis(phenylmethyl)urea

Systemtic Name: 3-(4-methyl-2-nitro-phenyl)-1,1-bis(phenylmethyl)urea Openeye Name: 1,1-dibenzyl-3-(4-methyl-2-nitro-phenyl)urea CAS Name: 3-(4-methyl-2-nitrophenyl)-1,1-bis(phenylmethyl)urea IUPAC Name: 1,1-dibenzyl-3-(4-methyl-2-nitrophenyl)urea Traditional Name: 1,1-dibenzyl-3-(4-methyl-2-nitro-phenyl)urea Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O3/c1-17-12-13-20(21(14-17)25(27)28)23-22(26)24(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,23,26)