4-[[(4-bromophenyl)amino]-diphenoxyphosphoryl-methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[[(4-bromophenyl)amino]-diphenoxyphosphoryl-methyl]-N,N-dimethyl-aniline Openeye Name: 4-[(4-bromoanilino)-diphenoxyphosphoryl-methyl]-N,N-dimethyl-aniline CAS Name: 4-[(4-bromoanilino)-diphenoxyphosphorylmethyl]-N,N-dimethylaniline IUPAC Name: 4-[(4-bromoanilino)-diphenoxyphosphorylmethyl]-N,N-dimethylaniline Traditional Name: [4-[(4-bromoanilino)-diphenoxyphosphoryl-methyl]phenyl]-dimethyl-amine Formula: C27H26BrN2O3P MolecularWeight: 537.384701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(NC2=CC=C(C=C2)Br)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(NC2=CC=C(C=C2)Br)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H26BrN2O3P/c1-30(2)24-19-13-21(14-20-24)27(29-23-17-15-22(28)16-18-23)34(31,32-25-9-5-3-6-10-25)33-26-11-7-4-8-12-26/h3-20,27,29H,1-2H3