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

Systemtic Name: 2-[4-[2-methoxyethyl-(phenylmethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Openeye Name: 2-[4-[benzyl(2-methoxyethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid CAS Name: 2-[4-[2-methoxyethyl-(phenylmethyl)sulfamoyl]phenyl]-4-[4-(1-pyrrolidinyl)phenyl]butanoic acid IUPAC Name: 2-[4-[benzyl(2-methoxyethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Traditional Name: 2-[4-[benzyl(2-methoxyethyl)sulfamoyl]phenyl]-4-(4-pyrrolidinophenyl)butyric acid Formula: C30H36N2O5S MolecularWeight: 536.68224

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)N4CCCC4)C(=O)O

Isomeric SMILES

COCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)N4CCCC4)C(=O)O

InChI

InChI=1S/C30H36N2O5S/c1-37-22-21-32(23-25-7-3-2-4-8-25)38(35,36)28-16-12-26(13-17-28)29(30(33)34)18-11-24-9-14-27(15-10-24)31-19-5-6-20-31/h2-4,7-10,12-17,29H,5-6,11,18-23H2,1H3,(H,33,34)