[4-[4-(4-chlorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1H-pyrazol-2-yl]cyclohexyl]carbamic acid

Systemtic Name: [4-[4-(4-chlorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1H-pyrazol-2-yl]cyclohexyl]carbamic acid Openeye Name: [4-[4-(4-chlorophenyl)-5-oxo-3-(4-pyridyl)-1H-pyrazol-2-yl]cyclohexyl]carbamic acid CAS Name: [4-[4-(4-chlorophenyl)-5-oxo-3-pyridin-4-yl-1H-pyrazol-2-yl]cyclohexyl]carbamic acid IUPAC Name: [4-[4-(4-chlorophenyl)-5-oxo-3-pyridin-4-yl-1H-pyrazol-2-yl]cyclohexyl]carbamic acid Traditional Name: [4-[4-(4-chlorophenyl)-3-keto-5-(4-pyridyl)-3-pyrazolin-1-yl]cyclohexyl]carbamic acid Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)O)N2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CC(CCC1NC(=O)O)N2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C21H21ClN4O3/c22-15-3-1-13(2-4-15)18-19(14-9-11-23-12-10-14)26(25-20(18)27)17-7-5-16(6-8-17)24-21(28)29/h1-4,9-12,16-17,24H,5-8H2,(H,25,27)(H,28,29)