3-azanyl-4-methyl-5-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid

Systemtic Name: 3-azanyl-4-methyl-5-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid Openeye Name: 3-amino-4-methyl-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid CAS Name: 3-amino-4-methyl-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid IUPAC Name: 3-amino-4-methyl-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid Traditional Name: 3-amino-5-(5-keto-3-methyl-3-pyrazolin-1-yl)-4-methyl-besylic acid Formula: C11H13N3O4S MolecularWeight: 283.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC(=CC(=C2C)N)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC(=CC(=C2C)N)S(=O)(=O)O

InChI

InChI=1S/C11H13N3O4S/c1-6-3-11(15)14(13-6)10-5-8(19(16,17)18)4-9(12)7(10)2/h3-5,13H,12H2,1-2H3,(H,16,17,18)