7-(1-benzothiophen-2-yl)-2-sulfanyl-heptanoic acid

Systemtic Name: 7-(1-benzothiophen-2-yl)-2-sulfanyl-heptanoic acid Openeye Name: 7-(benzothiophen-2-yl)-2-sulfanyl-heptanoic acid CAS Name: 7-(1-benzothiophen-2-yl)-2-mercaptoheptanoic acid IUPAC Name: 7-(1-benzothiophen-2-yl)-2-sulfanylheptanoic acid Traditional Name: 7-(benzothiophen-2-yl)-2-mercapto-enanthic acid Formula: C15H18O2S2 MolecularWeight: 294.43222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)CCCCCC(C(=O)O)S

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)CCCCCC(C(=O)O)S

InChI

InChI=1S/C15H18O2S2/c16-15(17)13(18)8-3-1-2-7-12-10-11-6-4-5-9-14(11)19-12/h4-6,9-10,13,18H,1-3,7-8H2,(H,16,17)