3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoic acid

Systemtic Name: 3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoic acid Openeye Name: 3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoic acid CAS Name: 3-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]benzoic acid IUPAC Name: 3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 3-[(3-pyrrolidinosulfonylbenzoyl)amino]benzoic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C18H18N2O5S/c21-17(19-15-7-3-6-14(11-15)18(22)23)13-5-4-8-16(12-13)26(24,25)20-9-1-2-10-20/h3-8,11-12H,1-2,9-10H2,(H,19,21)(H,22,23)