5-[[3-methyl-4-[1-oxidanyl-1-oxidanylidene-4-(4-pyrrolidin-1-ylphenyl)butan-2-yl]phenyl]sulfonylamino]pentanoic acid

Systemtic Name: 5-[[3-methyl-4-[1-oxidanyl-1-oxidanylidene-4-(4-pyrrolidin-1-ylphenyl)butan-2-yl]phenyl]sulfonylamino]pentanoic acid Openeye Name: 5-[[4-[1-carboxy-3-(4-pyrrolidin-1-ylphenyl)propyl]-3-methyl-phenyl]sulfonylamino]pentanoic acid CAS Name: 5-[[4-[1-hydroxy-1-oxo-4-[4-(1-pyrrolidinyl)phenyl]butan-2-yl]-3-methylphenyl]sulfonylamino]pentanoic acid IUPAC Name: 5-[[4-[1-hydroxy-1-oxo-4-(4-pyrrolidin-1-ylphenyl)butan-2-yl]-3-methylphenyl]sulfonylamino]pentanoic acid Traditional Name: 5-[[4-[1-carboxy-3-(4-pyrrolidinophenyl)propyl]-3-methyl-phenyl]sulfonylamino]valeric acid Formula: C26H34N2O6S MolecularWeight: 502.62296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCCCC(=O)O)C(CCC2=CC=C(C=C2)N3CCCC3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCCCC(=O)O)C(CCC2=CC=C(C=C2)N3CCCC3)C(=O)O

InChI

InChI=1S/C26H34N2O6S/c1-19-18-22(35(33,34)27-15-3-2-6-25(29)30)12-14-23(19)24(26(31)32)13-9-20-7-10-21(11-8-20)28-16-4-5-17-28/h7-8,10-12,14,18,24,27H,2-6,9,13,15-17H2,1H3,(H,29,30)(H,31,32)