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

Systemtic Name: [1-chloranyl-2-[(4-methylphenyl)carbonylamino]-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-triphenyl-phosphanium perchlorate Openeye Name: [3-anilino-1-chloro-2-[(4-methylbenzoyl)amino]-3-oxo-prop-1-enyl]-triphenyl-phosphonium perchlorate CAS Name: [3-anilino-1-chloro-2-[[(4-methylphenyl)-oxomethyl]amino]-3-oxoprop-1-enyl]-triphenylphosphonium perchlorate IUPAC Name: [3-anilino-1-chloro-2-[(4-methylbenzoyl)amino]-3-oxoprop-1-enyl]-triphenylphosphanium perchlorate Traditional Name: [3-anilino-1-chloro-3-keto-2-(p-toluoylamino)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)C(=O)NC(=C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)C(=O)NC5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)C(=O)NC5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C35H28ClN2O2P.ClHO4/c1-26-22-24-27(25-23-26)34(39)38-32(35(40)37-28-14-6-2-7-15-28)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)