3-(5-azanyl-3-methyl-pyrazol-1-yl)-4-methoxy-benzenesulfonic acid

Systemtic Name: 3-(5-azanyl-3-methyl-pyrazol-1-yl)-4-methoxy-benzenesulfonic acid Openeye Name: 3-(5-amino-3-methyl-pyrazol-1-yl)-4-methoxy-benzenesulfonic acid CAS Name: 3-(5-amino-3-methyl-1-pyrazolyl)-4-methoxybenzenesulfonic acid IUPAC Name: 3-(5-amino-3-methylpyrazol-1-yl)-4-methoxybenzenesulfonic acid Traditional Name: 3-(5-amino-3-methyl-pyrazol-1-yl)-4-methoxy-besylic acid Formula: C11H13N3O4S MolecularWeight: 283.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)S(=O)(=O)O)OC

Isomeric SMILES

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)S(=O)(=O)O)OC

InChI

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