(2-benzamido-3-oxidanylidene-3-piperidin-1-yl-prop-1-enyl)-triphenyl-phosphanium chloride

Systemtic Name: (2-benzamido-3-oxidanylidene-3-piperidin-1-yl-prop-1-enyl)-triphenyl-phosphanium chloride Openeye Name: [2-benzamido-3-oxo-3-(1-piperidyl)prop-1-enyl]-triphenyl-phosphonium chloride CAS Name: [2-benzamido-3-oxo-3-(1-piperidinyl)prop-1-enyl]-triphenylphosphonium chloride IUPAC Name: (2-benzamido-3-oxo-3-piperidin-1-ylprop-1-enyl)-triphenylphosphanium chloride Traditional Name: (2-benzamido-3-keto-3-piperidino-prop-1-enyl)-triphenyl-phosphonium chloride Formula: C33H32ClN2O2P MolecularWeight: 555.046141

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1CCN(CC1)C(=O)C(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C33H31N2O2P.ClH/c36-32(27-16-6-1-7-17-27)34-31(33(37)35-24-14-5-15-25-35)26-38(28-18-8-2-9-19-28,29-20-10-3-11-21-29)30-22-12-4-13-23-30;/h1-4,6-13,16-23,26H,5,14-15,24-25H2;1H