(3S)-3-methyl-5-oxidanylidene-5-[2-(4-sulfamoylphenyl)ethylamino]pentanoic acid

Systemtic Name: (3S)-3-methyl-5-oxidanylidene-5-[2-(4-sulfamoylphenyl)ethylamino]pentanoic acid Openeye Name: (3S)-3-methyl-5-oxo-5-[2-(4-sulfamoylphenyl)ethylamino]pentanoic acid CAS Name: (3S)-3-methyl-5-oxo-5-[2-(4-sulfamoylphenyl)ethylamino]pentanoic acid IUPAC Name: (3S)-3-methyl-5-oxo-5-[2-(4-sulfamoylphenyl)ethylamino]pentanoic acid Traditional Name: (3S)-5-keto-3-methyl-5-[2-(4-sulfamoylphenyl)ethylamino]valeric acid Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)CC(=O)O

Isomeric SMILES

C[C@@H](CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)CC(=O)O

InChI

InChI=1S/C14H20N2O5S/c1-10(9-14(18)19)8-13(17)16-7-6-11-2-4-12(5-3-11)22(15,20)21/h2-5,10H,6-9H2,1H3,(H,16,17)(H,18,19)(H2,15,20,21)/t10-/m0/s1