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

Systemtic Name: 4-azanyl-5-(2,2-dimethyloxan-4-yl)-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-amino-5-(2,2-dimethyltetrahydropyran-4-yl)-2-phenyl-1H-pyrazol-3-one CAS Name: 4-amino-5-(2,2-dimethyl-4-oxanyl)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-amino-5-(2,2-dimethyloxan-4-yl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-amino-5-(2,2-dimethyltetrahydropyran-4-yl)-2-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(C(=O)N(N2)C3=CC=CC=C3)N)C

Isomeric SMILES

CC1(CC(CCO1)C2=C(C(=O)N(N2)C3=CC=CC=C3)N)C

InChI

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