tert-butyl 4-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(3-oxo-2-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate CAS Name: 4-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-oxo-2-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate Traditional Name: 4-(5-keto-1-phenyl-3-pyrazolin-3-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C19H25N3O3/c1-19(2,3)25-18(24)21-11-9-14(10-12-21)16-13-17(23)22(20-16)15-7-5-4-6-8-15/h4-8,13-14,20H,9-12H2,1-3H3