5-[4-(5-methylhexan-2-ylamino)phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[4-(5-methylhexan-2-ylamino)phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[4-(1,4-dimethylpentylamino)phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[4-(5-methylhexan-2-ylamino)phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[4-(5-methylhexan-2-ylamino)phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[4-(1,4-dimethylpentylamino)phenyl]-3-pyrazolin-3-one Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC1=CC=C(C=C1)C2=CC(=O)NN2

Isomeric SMILES

CC(C)CCC(C)NC1=CC=C(C=C1)C2=CC(=O)NN2

InChI

InChI=1S/C16H23N3O/c1-11(2)4-5-12(3)17-14-8-6-13(7-9-14)15-10-16(20)19-18-15/h6-12,17H,4-5H2,1-3H3,(H2,18,19,20)