3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-3-yl]amino]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C17H18ClN3O MolecularWeight: 315.79732

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=NNC(=C2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=NNC(=C2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C17H18ClN3O/c1-17(2)9-13(7-14(22)10-17)19-16-8-15(20-21-16)11-3-5-12(18)6-4-11/h3-8H,9-10H2,1-2H3,(H2,19,20,21)