oxidanylidene-[3-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propyl]-(quinolin-2-ylsulfanylmethyl)phosphanium

Systemtic Name: oxidanylidene-[3-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propyl]-(quinolin-2-ylsulfanylmethyl)phosphanium Openeye Name: (2-benzyl-3-hydroxy-3-oxo-propyl)-oxo-(2-quinolylsulfanylmethyl)phosphonium CAS Name: [3-hydroxy-3-oxo-2-(phenylmethyl)propyl]-oxo-[(2-quinolinylthio)methyl]phosphonium IUPAC Name: (2-benzyl-3-hydroxy-3-oxopropyl)-oxo-(quinolin-2-ylsulfanylmethyl)phosphanium Traditional Name: (2-benzyl-3-hydroxy-3-keto-propyl)-keto-[(2-quinolylthio)methyl]phosphonium Formula: C20H19NO3PS+ MolecularWeight: 384.408521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C[P+](=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C[P+](=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C20H18NO3PS/c22-20(23)17(12-15-6-2-1-3-7-15)13-25(24)14-26-19-11-10-16-8-4-5-9-18(16)21-19/h1-11,17H,12-14H2/p+1