2-oxidanyl-2-(6-phenylhexylsulfanylmethyl)butanedioic acid

Systemtic Name: 2-oxidanyl-2-(6-phenylhexylsulfanylmethyl)butanedioic acid Openeye Name: 2-hydroxy-2-(6-phenylhexylsulfanylmethyl)butanedioic acid CAS Name: 2-hydroxy-2-[(6-phenylhexylthio)methyl]butanedioic acid IUPAC Name: 2-hydroxy-2-(6-phenylhexylsulfanylmethyl)butanedioic acid Traditional Name: 2-hydroxy-2-[(6-phenylhexylthio)methyl]succinic acid Formula: C17H24O5S MolecularWeight: 340.43446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCSCC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCSCC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C17H24O5S/c18-15(19)12-17(22,16(20)21)13-23-11-7-2-1-4-8-14-9-5-3-6-10-14/h3,5-6,9-10,22H,1-2,4,7-8,11-13H2,(H,18,19)(H,20,21)