[2-benzamido-1-chloranyl-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate

Systemtic Name: [2-benzamido-1-chloranyl-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate Openeye Name: [2-benzamido-1-chloro-3-(4-methylanilino)-3-oxo-prop-1-enyl]-triphenyl-phosphonium perchlorate CAS Name: [2-benzamido-1-chloro-3-(4-methylanilino)-3-oxoprop-1-enyl]-triphenylphosphonium perchlorate IUPAC Name: [2-benzamido-1-chloro-3-(4-methylanilino)-3-oxoprop-1-enyl]-triphenylphosphanium perchlorate Traditional Name: [2-benzamido-1-chloro-3-keto-3-(p-toluidino)prop-1-enyl]-triphenyl-phosphonium perchlorate Formula: C35H29Cl2N2O6P MolecularWeight: 675.494321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)NC(=O)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(=C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)NC(=O)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C35H28ClN2O2P.ClHO4/c1-26-22-24-28(25-23-26)37-35(40)32(38-34(39)27-14-6-2-7-15-27)33(36)41(29-16-8-3-9-17-29,30-18-10-4-11-19-30)31-20-12-5-13-21-31;2-1(3,4)5/h2-25H,1H3,(H-,37,38,39,40);(H,2,3,4,5)