8-(4-acetamidophenyl)-5-thiophen-2-yl-octanoic acid

Systemtic Name: 8-(4-acetamidophenyl)-5-thiophen-2-yl-octanoic acid Openeye Name: 8-(4-acetamidophenyl)-5-(2-thienyl)octanoic acid CAS Name: 8-(4-acetamidophenyl)-5-thiophen-2-yloctanoic acid IUPAC Name: 8-(4-acetamidophenyl)-5-thiophen-2-yloctanoic acid Traditional Name: 8-(4-acetamidophenyl)-5-(2-thienyl)caprylic acid Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CCCC(CCCC(=O)O)C2=CC=CS2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CCCC(CCCC(=O)O)C2=CC=CS2

InChI

InChI=1S/C20H25NO3S/c1-15(22)21-18-12-10-16(11-13-18)5-2-6-17(7-3-9-20(23)24)19-8-4-14-25-19/h4,8,10-14,17H,2-3,5-7,9H2,1H3,(H,21,22)(H,23,24)