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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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