2-[[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]carbamoyl]benzoic acid

Systemtic Name: 2-[[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]carbamoyl]benzoic acid Openeye Name: 2-[[[4-(1-piperidylsulfonyl)benzoyl]amino]carbamoyl]benzoic acid CAS Name: 2-[oxo-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]hydrazo]methyl]benzoic acid IUPAC Name: 2-[[(4-piperidin-1-ylsulfonylbenzoyl)amino]carbamoyl]benzoic acid Traditional Name: 2-[[(4-piperidinosulfonylbenzoyl)amino]carbamoyl]benzoic acid Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H21N3O6S/c24-18(21-22-19(25)16-6-2-3-7-17(16)20(26)27)14-8-10-15(11-9-14)30(28,29)23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-13H2,(H,21,24)(H,22,25)(H,26,27)