5-[4-[(2-methylcyclohexyl)amino]phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[4-[(2-methylcyclohexyl)amino]phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[4-[(2-methylcyclohexyl)amino]phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[4-[(2-methylcyclohexyl)amino]phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[4-[(2-methylcyclohexyl)amino]phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[4-[(2-methylcyclohexyl)amino]phenyl]-3-pyrazolin-3-one Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=CC=C(C=C2)C3=CC(=O)NN3

Isomeric SMILES

CC1CCCCC1NC2=CC=C(C=C2)C3=CC(=O)NN3

InChI

InChI=1S/C16H21N3O/c1-11-4-2-3-5-14(11)17-13-8-6-12(7-9-13)15-10-16(20)19-18-15/h6-11,14,17H,2-5H2,1H3,(H2,18,19,20)