3-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]butanoic acid Openeye Name: 3-[(1-methyl-2-oxo-indolin-5-yl)sulfonylamino]butanoic acid CAS Name: 3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]butanoic acid IUPAC Name: 3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]butanoic acid Traditional Name: 3-[(2-keto-1-methyl-indolin-5-yl)sulfonylamino]butyric acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)C2)C

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)C2)C

InChI

InChI=1S/C13H16N2O5S/c1-8(5-13(17)18)14-21(19,20)10-3-4-11-9(6-10)7-12(16)15(11)2/h3-4,6,8,14H,5,7H2,1-2H3,(H,17,18)