5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-[(4-pyridin-3-yloxyphenyl)sulfonylmethyl]pentanoic acid

Systemtic Name: 5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-[(4-pyridin-3-yloxyphenyl)sulfonylmethyl]pentanoic acid Openeye Name: 5-(2,5-dioxopyrrolidin-1-yl)-2-[[4-(3-pyridyloxy)phenyl]sulfonylmethyl]pentanoic acid CAS Name: 5-(2,5-dioxo-1-pyrrolidinyl)-2-[[4-(3-pyridinyloxy)phenyl]sulfonylmethyl]pentanoic acid IUPAC Name: 5-(2,5-dioxopyrrolidin-1-yl)-2-[(4-pyridin-3-yloxyphenyl)sulfonylmethyl]pentanoic acid Traditional Name: 2-[[4-(3-pyridyloxy)phenyl]sulfonylmethyl]-5-succinimido-valeric acid Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CCCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CN=CC=C3)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1=O)CCCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C21H22N2O7S/c24-19-9-10-20(25)23(19)12-2-3-15(21(26)27)14-31(28,29)18-7-5-16(6-8-18)30-17-4-1-11-22-13-17/h1,4-8,11,13,15H,2-3,9-10,12,14H2,(H,26,27)