3-[[2-(2-methylpentanoylamino)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[2-(2-methylpentanoylamino)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[2-(2-methylpentanoylamino)phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-methyl-1-oxopentyl)amino]phenyl]sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[[2-(2-methylpentanoylamino)phenyl]sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[[2-(2-methylpentanoylamino)phenyl]sulfonylamino]butyric acid Formula: C16H22N2O6S MolecularWeight: 370.42068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=CC=CC=C1S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CCCC(C)C(=O)NC1=CC=CC=C1S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C16H22N2O6S/c1-3-6-11(2)16(22)17-13-7-4-5-8-14(13)25(23,24)18-12(10-19)9-15(20)21/h4-5,7-8,10-12,18H,3,6,9H2,1-2H3,(H,17,22)(H,20,21)