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

Systemtic Name: [(Z)-2-benzamido-3-oxidanylidene-1-phenyl-3-[(phenylmethyl)amino]prop-1-enyl]-triphenyl-phosphanium perchlorate Openeye Name: [(Z)-2-benzamido-3-(benzylamino)-3-oxo-1-phenyl-prop-1-enyl]-triphenyl-phosphonium perchlorate CAS Name: [(Z)-2-benzamido-3-oxo-1-phenyl-3-[(phenylmethyl)amino]prop-1-enyl]-triphenylphosphonium perchlorate IUPAC Name: [(Z)-2-benzamido-3-(benzylamino)-3-oxo-1-phenylprop-1-enyl]-triphenylphosphanium perchlorate Traditional Name: [(Z)-2-benzamido-3-(benzylamino)-3-keto-1-phenyl-prop-1-enyl]-triphenyl-phosphonium perchlorate Formula: C41H34ClN2O6P MolecularWeight: 717.145221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=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.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=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.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C41H33N2O2P.ClHO4/c44-40(34-23-11-3-12-24-34)43-38(41(45)42-31-32-19-7-1-8-20-32)39(33-21-9-2-10-22-33)46(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37;2-1(3,4)5/h1-30H,31H2,(H-,42,43,44,45);(H,2,3,4,5)/b39-38-;