2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methyl-phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid

Systemtic Name: 2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methyl-phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Openeye Name: 2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methyl-phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid CAS Name: 2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methylphenyl]-4-[4-(1-pyrrolidinyl)phenyl]butanoic acid IUPAC Name: 2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methylphenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Traditional Name: 2-[4-[carboxymethyl(2-methoxyethyl)sulfamoyl]-2-methyl-phenyl]-4-(4-pyrrolidinophenyl)butyric acid Formula: C26H34N2O7S MolecularWeight: 518.62236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O7S/c1-19-17-22(36(33,34)28(15-16-35-2)18-25(29)30)10-12-23(19)24(26(31)32)11-7-20-5-8-21(9-6-20)27-13-3-4-14-27/h5-6,8-10,12,17,24H,3-4,7,11,13-16,18H2,1-2H3,(H,29,30)(H,31,32)