4-(2-azanylethyl)-5-phenyl-1,2-dihydropyrazol-3-one; sulfuric acid

Systemtic Name: 4-(2-azanylethyl)-5-phenyl-1,2-dihydropyrazol-3-one; sulfuric acid Openeye Name: 4-(2-aminoethyl)-5-phenyl-1,2-dihydropyrazol-3-one; sulfuric acid CAS Name: 4-(2-aminoethyl)-5-phenyl-1,2-dihydropyrazol-3-one; sulfuric acid IUPAC Name: 4-(2-aminoethyl)-5-phenyl-1,2-dihydropyrazol-3-one; sulfuric acid Traditional Name: 4-(2-aminoethyl)-5-phenyl-3-pyrazolin-3-one; sulfuric acid Formula: C11H15N3O5S MolecularWeight: 301.3189

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NN2)CCN.OS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NN2)CCN.OS(=O)(=O)O

InChI

InChI=1S/C11H13N3O.H2O4S/c12-7-6-9-10(13-14-11(9)15)8-4-2-1-3-5-8;1-5(2,3)4/h1-5H,6-7,12H2,(H2,13,14,15);(H2,1,2,3,4)