(2R)-2-ethyl-5-oxidanylidene-5-[(4-sulfamoylphenyl)amino]pentanoic acid

Systemtic Name: (2R)-2-ethyl-5-oxidanylidene-5-[(4-sulfamoylphenyl)amino]pentanoic acid Openeye Name: (2R)-2-ethyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid CAS Name: (2R)-2-ethyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid IUPAC Name: (2R)-2-ethyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid Traditional Name: (2R)-2-ethyl-5-keto-5-(4-sulfamoylanilino)valeric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CC[C@H](CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-2-9(13(17)18)3-8-12(16)15-10-4-6-11(7-5-10)21(14,19)20/h4-7,9H,2-3,8H2,1H3,(H,15,16)(H,17,18)(H2,14,19,20)/t9-/m1/s1