[(Z)-2-benzamido-3-[(4-methylphenyl)amino]-3-oxidanylidene-1-phenyl-prop-1-enyl]-triphenyl-phosphanium chloride

Systemtic Name: [(Z)-2-benzamido-3-[(4-methylphenyl)amino]-3-oxidanylidene-1-phenyl-prop-1-enyl]-triphenyl-phosphanium chloride Openeye Name: [(Z)-2-benzamido-3-(4-methylanilino)-3-oxo-1-phenyl-prop-1-enyl]-triphenyl-phosphonium chloride CAS Name: [(Z)-2-benzamido-3-(4-methylanilino)-3-oxo-1-phenylprop-1-enyl]-triphenylphosphonium chloride IUPAC Name: [(Z)-2-benzamido-3-(4-methylanilino)-3-oxo-1-phenylprop-1-enyl]-triphenylphosphanium chloride Traditional Name: [(Z)-2-benzamido-3-keto-1-phenyl-3-(p-toluidino)prop-1-enyl]-triphenyl-phosphonium chloride Formula: C41H34ClN2O2P MolecularWeight: 653.147621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=C(C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C(\C2=CC=CC=C2)/[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)/NC(=O)C6=CC=CC=C6.[Cl-]

InChI

InChI=1S/C41H33N2O2P.ClH/c1-31-27-29-34(30-28-31)42-41(45)38(43-40(44)33-19-9-3-10-20-33)39(32-17-7-2-8-18-32)46(35-21-11-4-12-22-35,36-23-13-5-14-24-36)37-25-15-6-16-26-37;/h2-30H,1H3,(H-,42,43,44,45);1H/b39-38-;