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

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-(4-veratrylpiperazino)nicotinonitrile Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)N2CCN(CC2)CC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)N2CCN(CC2)CC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C21H26N4O2/c1-15-11-16(2)23-21(18(15)13-22)25-9-7-24(8-10-25)14-17-5-6-19(26-3)20(12-17)27-4/h5-6,11-12H,7-10,14H2,1-4H3