1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-[[4-[4-[[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]benzyl]-1-nitroso-urea Formula: C20H22Cl2N6O4 MolecularWeight: 481.33248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)N(CCCl)N=O)C2=CC=C(C=C2)CNC(=O)N(CCCl)N=O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)N(CCCl)N=O)C2=CC=C(C=C2)CNC(=O)N(CCCl)N=O

InChI

InChI=1S/C20H22Cl2N6O4/c21-9-11-27(25-31)19(29)23-13-15-1-5-17(6-2-15)18-7-3-16(4-8-18)14-24-20(30)28(26-32)12-10-22/h1-8H,9-14H2,(H,23,29)(H,24,30)