(2S)-2-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]butanedioic acid

Systemtic Name: (2S)-2-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]butanedioic acid Openeye Name: (2S)-2-[(4-chloro-3-sulfamoyl-benzoyl)amino]butanedioic acid CAS Name: (2S)-2-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]amino]butanedioic acid IUPAC Name: (2S)-2-[(4-chloro-3-sulfamoylbenzoyl)amino]butanedioic acid Traditional Name: (2S)-2-[(4-chloro-3-sulfamoyl-benzoyl)amino]succinic acid Formula: C11H11ClN2O7S MolecularWeight: 350.73224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC(CC(=O)O)C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N[C@@H](CC(=O)O)C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C11H11ClN2O7S/c12-6-2-1-5(3-8(6)22(13,20)21)10(17)14-7(11(18)19)4-9(15)16/h1-3,7H,4H2,(H,14,17)(H,15,16)(H,18,19)(H2,13,20,21)/t7-/m0/s1