N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-cyano-4-(4-morpholino-1-piperidyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-cyano-4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-cyano-4-(4-morpholinopiperidino)phenyl]-piperonylamide Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCOCC2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C#N

Isomeric SMILES

C1CN(CCC1N2CCOCC2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C#N

InChI

InChI=1S/C24H26N4O4/c25-15-18-13-19(26-24(29)17-1-4-22-23(14-17)32-16-31-22)2-3-21(18)28-7-5-20(6-8-28)27-9-11-30-12-10-27/h1-4,13-14,20H,5-12,16H2,(H,26,29)