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

Systemtic Name: 5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-[(4-phenoxyphenyl)sulfonylmethyl]pentanoic acid Openeye Name: 5-(2,5-dioxopyrrolidin-1-yl)-2-[(4-phenoxyphenyl)sulfonylmethyl]pentanoic acid CAS Name: 5-(2,5-dioxo-1-pyrrolidinyl)-2-[(4-phenoxyphenyl)sulfonylmethyl]pentanoic acid IUPAC Name: 5-(2,5-dioxopyrrolidin-1-yl)-2-[(4-phenoxyphenyl)sulfonylmethyl]pentanoic acid Traditional Name: 2-[(4-phenoxyphenyl)sulfonylmethyl]-5-succinimido-valeric acid Formula: C22H23NO7S MolecularWeight: 445.48552

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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=CC=CC=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO7S/c24-20-12-13-21(25)23(20)14-4-5-16(22(26)27)15-31(28,29)19-10-8-18(9-11-19)30-17-6-2-1-3-7-17/h1-3,6-11,16H,4-5,12-15H2,(H,26,27)