[(Z)-2-carboxy-8-(3-oxidanylpyridin-2-yl)sulfanyl-oct-2-enyl]-(2-methylpropyl)-oxidanylidene-phosphanium

Systemtic Name: [(Z)-2-carboxy-8-(3-oxidanylpyridin-2-yl)sulfanyl-oct-2-enyl]-(2-methylpropyl)-oxidanylidene-phosphanium Openeye Name: [(Z)-2-carboxy-8-[(3-hydroxy-2-pyridyl)sulfanyl]oct-2-enyl]-isobutyl-oxo-phosphonium CAS Name: [(Z)-2-carboxy-8-[(3-hydroxy-2-pyridinyl)thio]oct-2-enyl]-(2-methylpropyl)-oxophosphonium IUPAC Name: [(Z)-2-carboxy-8-(3-hydroxypyridin-2-yl)sulfanyloct-2-enyl]-(2-methylpropyl)-oxophosphanium Traditional Name: [(Z)-2-carboxy-8-[(3-hydroxy-2-pyridyl)thio]oct-2-enyl]-isobutyl-keto-phosphonium Formula: C18H27NO4PS+ MolecularWeight: 384.450041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[P+](=O)CC(=CCCCCCSC1=C(C=CC=N1)O)C(=O)O

Isomeric SMILES

CC(C)C[P+](=O)C/C(=C\CCCCCSC1=C(C=CC=N1)O)/C(=O)O

InChI

InChI=1S/C18H26NO4PS/c1-14(2)12-24(23)13-15(18(21)22)8-5-3-4-6-11-25-17-16(20)9-7-10-19-17/h7-10,14H,3-6,11-13H2,1-2H3,(H-,20,21,22)/p+1/b15-8+