4-azanyl-2-chloranyl-5-oxidanyl-benzenesulfonamide; 5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-azanyl-2-chloranyl-5-oxidanyl-benzenesulfonamide; 5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-amino-2-chloro-5-hydroxy-benzenesulfonamide; 5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-amino-2-chloro-5-hydroxybenzenesulfonamide; 5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-amino-2-chloro-5-hydroxybenzenesulfonamide; 5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-amino-2-chloro-5-hydroxy-benzenesulfonamide; 5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C16H17ClN4O4S MolecularWeight: 396.84858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC=CC=C2.C1=C(C(=CC(=C1Cl)S(=O)(=O)N)O)N

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC=CC=C2.C1=C(C(=CC(=C1Cl)S(=O)(=O)N)O)N

InChI

InChI=1S/C10H10N2O.C6H7ClN2O3S/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9;7-3-1-4(8)5(10)2-6(3)13(9,11)12/h2-7,11H,1H3;1-2,10H,8H2,(H2,9,11,12)