2-[[4-[2-(4-pyrrolidin-1-ylphenyl)butanoyloxy]phenyl]sulfonylamino]-2-thiophen-2-yl-ethanoic acid

Systemtic Name: 2-[[4-[2-(4-pyrrolidin-1-ylphenyl)butanoyloxy]phenyl]sulfonylamino]-2-thiophen-2-yl-ethanoic acid Openeye Name: 2-[[4-[2-(4-pyrrolidin-1-ylphenyl)butanoyloxy]phenyl]sulfonylamino]-2-(2-thienyl)acetic acid CAS Name: 2-[[4-[1-oxo-2-[4-(1-pyrrolidinyl)phenyl]butoxy]phenyl]sulfonylamino]-2-thiophen-2-ylacetic acid IUPAC Name: 2-[[4-[2-(4-pyrrolidin-1-ylphenyl)butanoyloxy]phenyl]sulfonylamino]-2-thiophen-2-ylacetic acid Traditional Name: 2-[[4-[2-(4-pyrrolidinophenyl)butanoyloxy]phenyl]sulfonylamino]-2-(2-thienyl)acetic acid Formula: C26H28N2O6S2 MolecularWeight: 528.64032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)N2CCCC2)C(=O)OC3=CC=C(C=C3)S(=O)(=O)NC(C4=CC=CS4)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)N2CCCC2)C(=O)OC3=CC=C(C=C3)S(=O)(=O)NC(C4=CC=CS4)C(=O)O

InChI

InChI=1S/C26H28N2O6S2/c1-2-22(18-7-9-19(10-8-18)28-15-3-4-16-28)26(31)34-20-11-13-21(14-12-20)36(32,33)27-24(25(29)30)23-6-5-17-35-23/h5-14,17,22,24,27H,2-4,15-16H2,1H3,(H,29,30)