2,3-bis(oxidanyl)butanedioic acid; 4-(2-phenylsulfanylethyl)pyridine

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; 4-(2-phenylsulfanylethyl)pyridine Openeye Name: 2,3-dihydroxybutanedioic acid; 4-(2-phenylsulfanylethyl)pyridine CAS Name: 2,3-dihydroxybutanedioic acid; 4-[2-(phenylthio)ethyl]pyridine IUPAC Name: 2,3-dihydroxybutanedioic acid; 4-(2-phenylsulfanylethyl)pyridine Traditional Name: 4-[2-(phenylthio)ethyl]pyridine; tartaric acid Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC2=CC=NC=C2.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCC2=CC=NC=C2.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C13H13NS.C4H6O6/c1-2-4-13(5-3-1)15-11-8-12-6-9-14-10-7-12;5-1(3(7)8)2(6)4(9)10/h1-7,9-10H,8,11H2;1-2,5-6H,(H,7,8)(H,9,10)