3-azanyl-4-(2,2-dimethyloxan-4-yl)-2-phenyl-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-4-(2,2-dimethyloxan-4-yl)-2-phenyl-1H-pyrazol-5-one Openeye Name: 3-amino-4-(2,2-dimethyltetrahydropyran-4-yl)-2-phenyl-1H-pyrazol-5-one CAS Name: 3-amino-4-(2,2-dimethyl-4-oxanyl)-2-phenyl-1H-pyrazol-5-one IUPAC Name: 3-amino-4-(2,2-dimethyloxan-4-yl)-2-phenyl-1H-pyrazol-5-one Traditional Name: 5-amino-4-(2,2-dimethyltetrahydropyran-4-yl)-1-phenyl-3-pyrazolin-3-one Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C2=C(N(NC2=O)C3=CC=CC=C3)N)C

Isomeric SMILES

CC1(CC(CCO1)C2=C(N(NC2=O)C3=CC=CC=C3)N)C

InChI

InChI=1S/C16H21N3O2/c1-16(2)10-11(8-9-21-16)13-14(17)19(18-15(13)20)12-6-4-3-5-7-12/h3-7,11H,8-10,17H2,1-2H3,(H,18,20)