3,5-bis[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3,5-bis[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-benzenecarbonitrile Openeye Name: 4-hydroxy-3,5-bis[(4-methylpiperazin-1-yl)methyl]benzonitrile CAS Name: 4-hydroxy-3,5-bis[(4-methyl-1-piperazinyl)methyl]benzonitrile IUPAC Name: 4-hydroxy-3,5-bis[(4-methylpiperazin-1-yl)methyl]benzonitrile Traditional Name: 4-hydroxy-3,5-bis[(4-methylpiperazino)methyl]benzonitrile Formula: C19H29N5O MolecularWeight: 343.46646

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCN(CC3)C)C#N

Isomeric SMILES

CN1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCN(CC3)C)C#N

InChI

InChI=1S/C19H29N5O/c1-21-3-7-23(8-4-21)14-17-11-16(13-20)12-18(19(17)25)15-24-9-5-22(2)6-10-24/h11-12,25H,3-10,14-15H2,1-2H3