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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(3-cyanophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(3-cyanobenzoyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(3-cyanophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(3-cyanobenzoyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(3-cyanobenzoyl)isonipecotamide Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H19N3O4/c22-12-14-2-1-3-16(10-14)21(26)24-8-6-15(7-9-24)20(25)23-17-4-5-18-19(11-17)28-13-27-18/h1-5,10-11,15H,6-9,13H2,(H,23,25)