N-(2-cyano-3-methyl-butan-2-yl)-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]propanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]propanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]propanamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]propanamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]propanamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]propionamide Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)C(C)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C23H31N3O4/c1-15(2)23(4,14-24)25-22(28)16(3)26-9-7-17(8-10-26)21(27)18-5-6-19-20(13-18)30-12-11-29-19/h5-6,13,15-17H,7-12H2,1-4H3,(H,25,28)