2-[7-(4-chlorophenyl)carbonyl-2,3-dihydro-1-benzothiophen-5-yl]propanoic acid

Systemtic Name: 2-[7-(4-chlorophenyl)carbonyl-2,3-dihydro-1-benzothiophen-5-yl]propanoic acid Openeye Name: 2-[7-(4-chlorobenzoyl)-2,3-dihydrobenzothiophen-5-yl]propanoic acid CAS Name: 2-[7-[(4-chlorophenyl)-oxomethyl]-2,3-dihydro-1-benzothiophen-5-yl]propanoic acid IUPAC Name: 2-[7-(4-chlorobenzoyl)-2,3-dihydro-1-benzothiophen-5-yl]propanoic acid Traditional Name: 2-[7-(4-chlorobenzoyl)-2,3-dihydrobenzothiophen-5-yl]propionic acid Formula: C18H15ClO3S MolecularWeight: 346.8279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C(=C1)C(=O)C3=CC=C(C=C3)Cl)SCC2)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C(=C1)C(=O)C3=CC=C(C=C3)Cl)SCC2)C(=O)O

InChI

InChI=1S/C18H15ClO3S/c1-10(18(21)22)13-8-12-6-7-23-17(12)15(9-13)16(20)11-2-4-14(19)5-3-11/h2-5,8-10H,6-7H2,1H3,(H,21,22)