[2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(1-piperidyl)methanone CAS Name: [2-(4-chlorophenyl)-5-(4-nitrophenyl)-3-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-piperidino-methanone Formula: C21H19ClN4O3 MolecularWeight: 410.85356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19ClN4O3/c22-16-6-10-17(11-7-16)25-20(21(27)24-12-2-1-3-13-24)14-19(23-25)15-4-8-18(9-5-15)26(28)29/h4-11,14H,1-3,12-13H2