4-(6-azanylhexyl)-3-piperazin-1-yl-2-propoxy-benzenecarbonitrile

Systemtic Name: 4-(6-azanylhexyl)-3-piperazin-1-yl-2-propoxy-benzenecarbonitrile Openeye Name: 4-(6-aminohexyl)-3-piperazin-1-yl-2-propoxy-benzonitrile CAS Name: 4-(6-aminohexyl)-3-(1-piperazinyl)-2-propoxybenzonitrile IUPAC Name: 4-(6-aminohexyl)-3-piperazin-1-yl-2-propoxybenzonitrile Traditional Name: 4-(6-aminohexyl)-3-piperazino-2-propoxy-benzonitrile Formula: C20H32N4O MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1N2CCNCC2)CCCCCCN)C#N

Isomeric SMILES

CCCOC1=C(C=CC(=C1N2CCNCC2)CCCCCCN)C#N

InChI

InChI=1S/C20H32N4O/c1-2-15-25-20-18(16-22)9-8-17(7-5-3-4-6-10-21)19(20)24-13-11-23-12-14-24/h8-9,23H,2-7,10-15,21H2,1H3