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

Systemtic Name: 6-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-(2,3,4-trimethoxybenzyl)piperazino]nicotinonitrile Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=NC=C(C=C3)C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=NC=C(C=C3)C#N)OC)OC

InChI

InChI=1S/C20H24N4O3/c1-25-17-6-5-16(19(26-2)20(17)27-3)14-23-8-10-24(11-9-23)18-7-4-15(12-21)13-22-18/h4-7,13H,8-11,14H2,1-3H3