N-(1,3-benzodioxol-5-yl)-1-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-3-methyl-1-phenylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)isonipecotamide Formula: C24H23ClN4O4 MolecularWeight: 466.91682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C24H23ClN4O4/c1-15-21(22(25)29(27-15)18-5-3-2-4-6-18)24(31)28-11-9-16(10-12-28)23(30)26-17-7-8-19-20(13-17)33-14-32-19/h2-8,13,16H,9-12,14H2,1H3,(H,26,30)