[2-benzamido-3-[(2-nitrophenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate

Systemtic Name: [2-benzamido-3-[(2-nitrophenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate Openeye Name: [2-benzamido-3-(2-nitroanilino)-3-oxo-prop-1-enyl]-triphenyl-phosphonium perchlorate CAS Name: [2-benzamido-3-(2-nitroanilino)-3-oxoprop-1-enyl]-triphenylphosphonium perchlorate IUPAC Name: [2-benzamido-3-(2-nitroanilino)-3-oxoprop-1-enyl]-triphenylphosphanium perchlorate Traditional Name: [2-benzamido-3-keto-3-(2-nitroanilino)prop-1-enyl]-triphenyl-phosphonium perchlorate Formula: C34H27ClN3O8P MolecularWeight: 672.020241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5[N+](=O)[O-].[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5[N+](=O)[O-].[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C34H26N3O4P.ClHO4/c38-33(26-15-5-1-6-16-26)36-31(34(39)35-30-23-13-14-24-32(30)37(40)41)25-42(27-17-7-2-8-18-27,28-19-9-3-10-20-28)29-21-11-4-12-22-29;2-1(3,4)5/h1-25H,(H-,35,36,38,39);(H,2,3,4,5)