6-[4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]-1-piperidyl]pyridine-3-carbonitrile CAS Name: 6-[4-[[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]piperidin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[4-(2,5-dimethoxybenzyl)piperazine-1-carbonyl]piperidino]nicotinonitrile Formula: C25H31N5O3 MolecularWeight: 449.54534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C25H31N5O3/c1-32-22-4-5-23(33-2)21(15-22)18-28-11-13-30(14-12-28)25(31)20-7-9-29(10-8-20)24-6-3-19(16-26)17-27-24/h3-6,15,17,20H,7-14,18H2,1-2H3