4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-6-[bis(fluoranyl)methoxy]quinoline-3-carbonitrile

Systemtic Name: 4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-6-[bis(fluoranyl)methoxy]quinoline-3-carbonitrile Openeye Name: 4-[4-(azepane-1-carbonyl)-1-piperidyl]-6-(difluoromethoxy)quinoline-3-carbonitrile CAS Name: 4-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-6-(difluoromethoxy)-3-quinolinecarbonitrile IUPAC Name: 4-[4-(azepane-1-carbonyl)piperidin-1-yl]-6-(difluoromethoxy)quinoline-3-carbonitrile Traditional Name: 4-[4-(azepane-1-carbonyl)piperidino]-6-(difluoromethoxy)quinoline-3-carbonitrile Formula: C23H26F2N4O2 MolecularWeight: 428.474946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C3=C4C=C(C=CC4=NC=C3C#N)OC(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C3=C4C=C(C=CC4=NC=C3C#N)OC(F)F

InChI

InChI=1S/C23H26F2N4O2/c24-23(25)31-18-5-6-20-19(13-18)21(17(14-26)15-27-20)28-11-7-16(8-12-28)22(30)29-9-3-1-2-4-10-29/h5-6,13,15-16,23H,1-4,7-12H2