3-[(5-methyl-2-phenoxy-phenyl)sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(5-methyl-2-phenoxy-phenyl)sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[(5-methyl-2-phenoxy-phenyl)sulfonylamino]-4-oxo-butanoic acid CAS Name: 3-[(5-methyl-2-phenoxyphenyl)sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[(5-methyl-2-phenoxyphenyl)sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[(5-methyl-2-phenoxy-phenyl)sulfonylamino]butyric acid Formula: C17H17NO6S MolecularWeight: 363.38498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C17H17NO6S/c1-12-7-8-15(24-14-5-3-2-4-6-14)16(9-12)25(22,23)18-13(11-19)10-17(20)21/h2-9,11,13,18H,10H2,1H3,(H,20,21)