2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]-1H-pyridin-4-yl]butanoic acid

Systemtic Name: 2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]-1H-pyridin-4-yl]butanoic acid Openeye Name: 2-[3-(benzylsulfonylamino)-2-oxo-1H-pyridin-4-yl]butanoic acid CAS Name: 2-[2-oxo-3-[(phenylmethyl)sulfonylamino]-1H-pyridin-4-yl]butanoic acid IUPAC Name: 2-[3-(benzylsulfonylamino)-2-oxo-1H-pyridin-4-yl]butanoic acid Traditional Name: 2-[3-(benzylsulfonylamino)-2-keto-1H-pyridin-4-yl]butyric acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=O)NC=C1)NS(=O)(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(C1=C(C(=O)NC=C1)NS(=O)(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H18N2O5S/c1-2-12(16(20)21)13-8-9-17-15(19)14(13)18-24(22,23)10-11-6-4-3-5-7-11/h3-9,12,18H,2,10H2,1H3,(H,17,19)(H,20,21)