2-[4-(3-cyclohexylpropyl)piperazin-1-yl]-5-methoxy-benzenecarbonitrile

Systemtic Name: 2-[4-(3-cyclohexylpropyl)piperazin-1-yl]-5-methoxy-benzenecarbonitrile Openeye Name: 2-[4-(3-cyclohexylpropyl)piperazin-1-yl]-5-methoxy-benzonitrile CAS Name: 2-[4-(3-cyclohexylpropyl)-1-piperazinyl]-5-methoxybenzonitrile IUPAC Name: 2-[4-(3-cyclohexylpropyl)piperazin-1-yl]-5-methoxybenzonitrile Traditional Name: 2-[4-(3-cyclohexylpropyl)piperazino]-5-methoxy-benzonitrile Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)CCCC3CCCCC3)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)CCCC3CCCCC3)C#N

InChI

InChI=1S/C21H31N3O/c1-25-20-9-10-21(19(16-20)17-22)24-14-12-23(13-15-24)11-5-8-18-6-3-2-4-7-18/h9-10,16,18H,2-8,11-15H2,1H3