5-[6-(3-chlorophenyl)hexyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[6-(3-chlorophenyl)hexyl]thiophene-2-carboxylic acid Openeye Name: 5-[6-(3-chlorophenyl)hexyl]thiophene-2-carboxylic acid CAS Name: 5-[6-(3-chlorophenyl)hexyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[6-(3-chlorophenyl)hexyl]thiophene-2-carboxylic acid Traditional Name: 5-[6-(3-chlorophenyl)hexyl]-2-thenoic acid Formula: C17H19ClO2S MolecularWeight: 322.84956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCCCCCC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCCCCCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C17H19ClO2S/c18-14-8-5-7-13(12-14)6-3-1-2-4-9-15-10-11-16(21-15)17(19)20/h5,7-8,10-12H,1-4,6,9H2,(H,19,20)