[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium chloride

Systemtic Name: [2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium chloride Openeye Name: [2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-triphenyl-phosphonium chloride CAS Name: [2-(4-methyl-1-piperazinyl)-2-oxoethyl]-triphenylphosphonium chloride IUPAC Name: [2-(4-methylpiperazin-1-yl)-2-oxoethyl]-triphenylphosphanium chloride Traditional Name: [2-keto-2-(4-methylpiperazino)ethyl]-triphenyl-phosphonium chloride Formula: C25H28ClN2OP MolecularWeight: 438.929381

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C25H28N2OP.ClH/c1-26-17-19-27(20-18-26)25(28)21-29(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24;/h2-16H,17-21H2,1H3;1H/q+1;/p-1