N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C26H23N5O4 MolecularWeight: 469.49192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C5=NC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C5=NC=C(C=C5)C#N

InChI

InChI=1S/C26H23N5O4/c27-14-17-5-8-24(28-15-17)31-11-9-18(10-12-31)25(32)30-21-4-2-1-3-20(21)26(33)29-19-6-7-22-23(13-19)35-16-34-22/h1-8,13,15,18H,9-12,16H2,(H,29,33)(H,30,32)