5-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-2-methoxy-benzoic acid

Systemtic Name: 5-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-2-methoxy-benzoic acid Openeye Name: 5-(2-amino-1-methyl-2-oxo-ethyl)sulfonyl-2-methoxy-benzoic acid CAS Name: 5-(1-amino-1-oxopropan-2-yl)sulfonyl-2-methoxybenzoic acid IUPAC Name: 5-(1-amino-1-oxopropan-2-yl)sulfonyl-2-methoxybenzoic acid Traditional Name: 5-(2-amino-2-keto-1-methyl-ethyl)sulfonyl-2-methoxy-benzoic acid Formula: C11H13NO6S MolecularWeight: 287.28902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO6S/c1-6(10(12)13)19(16,17)7-3-4-9(18-2)8(5-7)11(14)15/h3-6H,1-2H3,(H2,12,13)(H,14,15)