2-[4-[2-(2-azanylethoxycarbonyl)pyrrolidin-1-yl]sulfonyl-2-methyl-phenyl]-4-(4-methylphenyl)butanoic acid

Systemtic Name: 2-[4-[2-(2-azanylethoxycarbonyl)pyrrolidin-1-yl]sulfonyl-2-methyl-phenyl]-4-(4-methylphenyl)butanoic acid Openeye Name: 2-[4-[2-(2-aminoethoxycarbonyl)pyrrolidin-1-yl]sulfonyl-2-methyl-phenyl]-4-(p-tolyl)butanoic acid CAS Name: 2-[4-[[2-[2-aminoethoxy(oxo)methyl]-1-pyrrolidinyl]sulfonyl]-2-methylphenyl]-4-(4-methylphenyl)butanoic acid IUPAC Name: 2-[4-[2-(2-aminoethoxycarbonyl)pyrrolidin-1-yl]sulfonyl-2-methylphenyl]-4-(4-methylphenyl)butanoic acid Traditional Name: 2-[4-[2-(2-aminoethoxycarbonyl)pyrrolidino]sulfonyl-2-methyl-phenyl]-4-(p-tolyl)butyric acid Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3C(=O)OCCN)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CCC(C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3C(=O)OCCN)C)C(=O)O

InChI

InChI=1S/C25H32N2O6S/c1-17-5-7-19(8-6-17)9-11-22(24(28)29)21-12-10-20(16-18(21)2)34(31,32)27-14-3-4-23(27)25(30)33-15-13-26/h5-8,10,12,16,22-23H,3-4,9,11,13-15,26H2,1-2H3,(H,28,29)