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

Systemtic Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidine-1-carbonyl]benzonitrile Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O4/c23-14-15-1-3-17(4-2-15)22(26)24-9-7-16(8-10-24)21(25)18-5-6-19-20(13-18)28-12-11-27-19/h1-6,13,16H,7-12H2