6-methoxy-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]quinoline-3-carbonitrile

Systemtic Name: 6-methoxy-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]quinoline-3-carbonitrile Openeye Name: 6-methoxy-2-[4-(3-pyridylmethyl)piperazin-1-yl]quinoline-3-carbonitrile CAS Name: 6-methoxy-2-[4-(3-pyridinylmethyl)-1-piperazinyl]-3-quinolinecarbonitrile IUPAC Name: 6-methoxy-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]quinoline-3-carbonitrile Traditional Name: 6-methoxy-2-[4-(3-pyridylmethyl)piperazino]quinoline-3-carbonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)N3CCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)N3CCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C21H21N5O/c1-27-19-4-5-20-17(12-19)11-18(13-22)21(24-20)26-9-7-25(8-10-26)15-16-3-2-6-23-14-16/h2-6,11-12,14H,7-10,15H2,1H3