4-chloranylphenolate; N-(3-oxidanylidenebutanoyl)sulfamate

Systemtic Name: 4-chloranylphenolate; N-(3-oxidanylidenebutanoyl)sulfamate Openeye Name: 4-chlorophenolate; N-(3-oxobutanoyl)sulfamate CAS Name: 4-chlorophenolate; N-(1,3-dioxobutyl)sulfamate IUPAC Name: 4-chlorophenolate; N-(3-oxobutanoyl)sulfamate Traditional Name: N-acetoacetylsulfamate; 4-chlorophenolate Formula: C10H10ClNO6S-2 MolecularWeight: 307.7075

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NS(=O)(=O)[O-].C1=CC(=CC=C1[O-])Cl

Isomeric SMILES

CC(=O)CC(=O)NS(=O)(=O)[O-].C1=CC(=CC=C1[O-])Cl

InChI

InChI=1S/C6H5ClO.C4H7NO5S/c7-5-1-3-6(8)4-2-5;1-3(6)2-4(7)5-11(8,9)10/h1-4,8H;2H2,1H3,(H,5,7)(H,8,9,10)/p-2