8-(1-benzothiophen-2-yl)-8-oxidanylidene-octanoic acid

Systemtic Name: 8-(1-benzothiophen-2-yl)-8-oxidanylidene-octanoic acid Openeye Name: 8-(benzothiophen-2-yl)-8-oxo-octanoic acid CAS Name: 8-(1-benzothiophen-2-yl)-8-oxooctanoic acid IUPAC Name: 8-(1-benzothiophen-2-yl)-8-oxooctanoic acid Traditional Name: 8-(benzothiophen-2-yl)-8-keto-caprylic acid Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=O)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C(=O)CCCCCCC(=O)O

InChI

InChI=1S/C16H18O3S/c17-13(8-3-1-2-4-10-16(18)19)15-11-12-7-5-6-9-14(12)20-15/h5-7,9,11H,1-4,8,10H2,(H,18,19)