3-azanyl-2-tert-butyl-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-2-tert-butyl-1H-pyrazol-5-one Openeye Name: 3-amino-2-tert-butyl-1H-pyrazol-5-one CAS Name: 3-amino-2-tert-butyl-1H-pyrazol-5-one IUPAC Name: 3-amino-2-tert-butyl-1H-pyrazol-5-one Traditional Name: 5-amino-1-tert-butyl-3-pyrazolin-3-one Formula: C7H13N3O MolecularWeight: 155.19762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=CC(=O)N1)N

Isomeric SMILES

CC(C)(C)N1C(=CC(=O)N1)N

InChI

InChI=1S/C7H13N3O/c1-7(2,3)10-5(8)4-6(11)9-10/h4H,8H2,1-3H3,(H,9,11)