6-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[4-[3-(1-piperidyl)propoxy]benzoyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[oxo-[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[4-(3-piperidin-1-ylpropoxy)benzoyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[4-(3-piperidinopropoxy)benzoyl]piperazino]nicotinonitrile Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C25H31N5O2/c26-19-21-5-10-24(27-20-21)29-14-16-30(17-15-29)25(31)22-6-8-23(9-7-22)32-18-4-13-28-11-2-1-3-12-28/h5-10,20H,1-4,11-18H2