4-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]methyl]benzonitrile CAS Name: 4-[[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]methyl]benzonitrile Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H22N2O3/c23-14-16-1-3-17(4-2-16)15-24-9-7-18(8-10-24)22(25)19-5-6-20-21(13-19)27-12-11-26-20/h1-6,13,18H,7-12,15H2