(E)-6-(4-chlorophenyl)sulfanyl-8-naphthalen-2-yl-5-oxidanyl-oct-7-enoic acid

Systemtic Name: (E)-6-(4-chlorophenyl)sulfanyl-8-naphthalen-2-yl-5-oxidanyl-oct-7-enoic acid Openeye Name: (E)-6-(4-chlorophenyl)sulfanyl-5-hydroxy-8-(2-naphthyl)oct-7-enoic acid CAS Name: (E)-6-[(4-chlorophenyl)thio]-5-hydroxy-8-(2-naphthalenyl)-7-octenoic acid IUPAC Name: (E)-6-(4-chlorophenyl)sulfanyl-5-hydroxy-8-naphthalen-2-yloct-7-enoic acid Traditional Name: (E)-6-[(4-chlorophenyl)thio]-5-hydroxy-8-(2-naphthyl)oct-7-enoic acid Formula: C24H23ClO3S MolecularWeight: 426.95562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=CC(C(CCCC(=O)O)O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)/C=C/C(C(CCCC(=O)O)O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H23ClO3S/c25-20-11-13-21(14-12-20)29-23(22(26)6-3-7-24(27)28)15-9-17-8-10-18-4-1-2-5-19(18)16-17/h1-2,4-5,8-16,22-23,26H,3,6-7H2,(H,27,28)/b15-9+