3-methyl-5-oxidanylidene-5-[(4-sulfamoylphenyl)amino]pentanoic acid

Systemtic Name: 3-methyl-5-oxidanylidene-5-[(4-sulfamoylphenyl)amino]pentanoic acid Openeye Name: 3-methyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid CAS Name: 3-methyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid IUPAC Name: 3-methyl-5-oxo-5-(4-sulfamoylanilino)pentanoic acid Traditional Name: 5-keto-3-methyl-5-(4-sulfamoylanilino)valeric acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O5S/c1-8(7-12(16)17)6-11(15)14-9-2-4-10(5-3-9)20(13,18)19/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)(H2,13,18,19)