1-[2-carboxy-4-(phenylsulfonyl)butyl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[2-carboxy-4-(phenylsulfonyl)butyl]cyclopentane-1-carboxylic acid Openeye Name: 1-[4-(benzenesulfonyl)-2-carboxy-butyl]cyclopentanecarboxylic acid CAS Name: 1-[4-(benzenesulfonyl)-2-carboxybutyl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[4-(benzenesulfonyl)-2-carboxybutyl]cyclopentane-1-carboxylic acid Traditional Name: 1-(4-besyl-2-carboxy-butyl)cyclopentanecarboxylic acid Formula: C17H22O6S MolecularWeight: 354.41798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CC(CCS(=O)(=O)C2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CCC(C1)(CC(CCS(=O)(=O)C2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C17H22O6S/c18-15(19)13(12-17(16(20)21)9-4-5-10-17)8-11-24(22,23)14-6-2-1-3-7-14/h1-3,6-7,13H,4-5,8-12H2,(H,18,19)(H,20,21)