5-azanyl-2-[4-(4-tert-butylphenoxy)phenyl]-4H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[4-(4-tert-butylphenoxy)phenyl]-4H-pyrazol-3-one Openeye Name: 5-amino-2-[4-(4-tert-butylphenoxy)phenyl]-4H-pyrazol-3-one CAS Name: 5-amino-2-[4-(4-tert-butylphenoxy)phenyl]-4H-pyrazol-3-one IUPAC Name: 5-amino-2-[4-(4-tert-butylphenoxy)phenyl]-4H-pyrazol-3-one Traditional Name: 5-amino-2-[4-(4-tert-butylphenoxy)phenyl]-2-pyrazolin-3-one Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)CC(=N3)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)CC(=N3)N

InChI

InChI=1S/C19H21N3O2/c1-19(2,3)13-4-8-15(9-5-13)24-16-10-6-14(7-11-16)22-18(23)12-17(20)21-22/h4-11H,12H2,1-3H3,(H2,20,21)