4-azanyl-5-tert-butyl-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-azanyl-5-tert-butyl-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-amino-5-tert-butyl-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-amino-5-tert-butyl-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-amino-5-tert-butyl-1-methyl-2-phenylpyrazol-3-one Traditional Name: 4-amino-5-tert-butyl-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=O)N(N1C)C2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)C1=C(C(=O)N(N1C)C2=CC=CC=C2)N

InChI

InChI=1S/C14H19N3O/c1-14(2,3)12-11(15)13(18)17(16(12)4)10-8-6-5-7-9-10/h5-9H,15H2,1-4H3