N-(1,3-benzodioxol-5-yl)-1-(2,5-diphenylpyrazol-3-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(2,5-diphenylpyrazol-3-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(2,5-diphenylpyrazole-3-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2,5-diphenyl-3-pyrazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(2,5-diphenylpyrazole-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(2,5-diphenylpyrazole-3-carbonyl)isonipecotamide Formula: C29H26N4O4 MolecularWeight: 494.54114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=NN4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=NN4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H26N4O4/c34-28(30-22-11-12-26-27(17-22)37-19-36-26)21-13-15-32(16-14-21)29(35)25-18-24(20-7-3-1-4-8-20)31-33(25)23-9-5-2-6-10-23/h1-12,17-18,21H,13-16,19H2,(H,30,34)