2-[7-(4-hexoxyphenyl)carbonyl-1-benzothiophen-5-yl]propanoic acid

Systemtic Name: 2-[7-(4-hexoxyphenyl)carbonyl-1-benzothiophen-5-yl]propanoic acid Openeye Name: 2-[7-(4-hexoxybenzoyl)benzothiophen-5-yl]propanoic acid CAS Name: 2-[7-[(4-hexoxyphenyl)-oxomethyl]-1-benzothiophen-5-yl]propanoic acid IUPAC Name: 2-[7-(4-hexoxybenzoyl)-1-benzothiophen-5-yl]propanoic acid Traditional Name: 2-[7-(4-hexoxybenzoyl)benzothiophen-5-yl]propionic acid Formula: C24H26O4S MolecularWeight: 410.52584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2)C(C)C(=O)O)C=CS3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2)C(C)C(=O)O)C=CS3

InChI

InChI=1S/C24H26O4S/c1-3-4-5-6-12-28-20-9-7-17(8-10-20)22(25)21-15-19(16(2)24(26)27)14-18-11-13-29-23(18)21/h7-11,13-16H,3-6,12H2,1-2H3,(H,26,27)