(1R,2S)-2-[(4-sulfamoylphenyl)methylcarbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[(4-sulfamoylphenyl)methylcarbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[(4-sulfamoylphenyl)methylcarbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[oxo-[(4-sulfamoylphenyl)methylamino]methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[(4-sulfamoylphenyl)methylcarbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(4-sulfamoylbenzyl)carbamoyl]cyclohexanecarboxylate Formula: C15H19N2O5S- MolecularWeight: 339.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c16-23(21,22)11-7-5-10(6-8-11)9-17-14(18)12-3-1-2-4-13(12)15(19)20/h5-8,12-13H,1-4,9H2,(H,17,18)(H,19,20)(H2,16,21,22)/p-1/t12-,13+/m0/s1