5-azanyl-2-[(4-cyclohexylphenyl)methyl]-4-methyl-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[(4-cyclohexylphenyl)methyl]-4-methyl-1H-pyrazol-3-one Openeye Name: 5-amino-2-[(4-cyclohexylphenyl)methyl]-4-methyl-1H-pyrazol-3-one CAS Name: 5-amino-2-[(4-cyclohexylphenyl)methyl]-4-methyl-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[(4-cyclohexylphenyl)methyl]-4-methyl-1H-pyrazol-3-one Traditional Name: 5-amino-2-(4-cyclohexylbenzyl)-4-methyl-3-pyrazolin-3-one Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)CC2=CC=C(C=C2)C3CCCCC3)N

Isomeric SMILES

CC1=C(NN(C1=O)CC2=CC=C(C=C2)C3CCCCC3)N

InChI

InChI=1S/C17H23N3O/c1-12-16(18)19-20(17(12)21)11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h7-10,14,19H,2-6,11,18H2,1H3