4-[[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-(furan-2-ylmethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-(furan-2-ylmethyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(2-furylmethyl)amino]methyl]benzonitrile CAS Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(2-furanylmethyl)amino]methyl]benzonitrile IUPAC Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(furan-2-ylmethyl)amino]methyl]benzonitrile Traditional Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(2-furfuryl)amino]methyl]benzonitrile Formula: C26H35N3O MolecularWeight: 405.5756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC2CCC(CC2)N(CC3=CC=C(C=C3)C#N)CC4=CC=CO4)N

Isomeric SMILES

C1CC(CCC1CC2CCC(CC2)N(CC3=CC=C(C=C3)C#N)CC4=CC=CO4)N

InChI

InChI=1S/C26H35N3O/c27-17-22-3-5-23(6-4-22)18-29(19-26-2-1-15-30-26)25-13-9-21(10-14-25)16-20-7-11-24(28)12-8-20/h1-6,15,20-21,24-25H,7-14,16,18-19,28H2