3,5-dimethyl-1-phenyl-pyrazol-4-amine hydrate

Systemtic Name: 3,5-dimethyl-1-phenyl-pyrazol-4-amine hydrate Openeye Name: 3,5-dimethyl-1-phenyl-pyrazol-4-amine hydrate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolamine hydrate IUPAC Name: 3,5-dimethyl-1-phenylpyrazol-4-amine hydrate Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)amine hydrate Formula: C11H15N3O MolecularWeight: 205.2563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)N.O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)N.O

InChI

InChI=1S/C11H13N3.H2O/c1-8-11(12)9(2)14(13-8)10-6-4-3-5-7-10;/h3-7H,12H2,1-2H3;1H2