1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea

Systemtic Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea Openeye Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea CAS Name: 1-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea IUPAC Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea Traditional Name: 1-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-nitrophenyl)urea Formula: C25H27ClN4O3 MolecularWeight: 466.95988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H27ClN4O3/c26-24-11-5-4-7-19(24)17-28-16-6-10-23(28)18-29(21-8-2-1-3-9-21)25(31)27-20-12-14-22(15-13-20)30(32)33/h4-7,10-16,21H,1-3,8-9,17-18H2,(H,27,31)