N-(2-cyanoquinolin-8-yl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]propanamide

Systemtic Name: N-(2-cyanoquinolin-8-yl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]propanamide Openeye Name: N-(2-cyano-8-quinolyl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]propanamide CAS Name: N-(2-cyano-8-quinolinyl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidinyl]propanamide IUPAC Name: N-(2-cyanoquinolin-8-yl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]propanamide Traditional Name: N-(2-cyano-8-quinolyl)-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]propionamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=C(C=C2)OCCO3)CCC(=O)NC4=CC=CC5=C4N=C(C=C5)C#N

Isomeric SMILES

C1CC(CN(C1)CC2=CC3=C(C=C2)OCCO3)CCC(=O)NC4=CC=CC5=C4N=C(C=C5)C#N

InChI

InChI=1S/C27H28N4O3/c28-16-22-9-8-21-4-1-5-23(27(21)29-22)30-26(32)11-7-19-3-2-12-31(17-19)18-20-6-10-24-25(15-20)34-14-13-33-24/h1,4-6,8-10,15,19H,2-3,7,11-14,17-18H2,(H,30,32)