5-[bis(phenylmethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)heptanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)heptanenitrile Openeye Name: 2-cyclohexyl-5-(dibenzylamino)-2-(4-fluorophenyl)heptanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)heptanenitrile IUPAC Name: 2-cyclohexyl-5-(dibenzylamino)-2-(4-fluorophenyl)heptanenitrile Traditional Name: 2-cyclohexyl-5-(dibenzylamino)-2-(4-fluorophenyl)enanthonitrile Formula: C33H39FN2 MolecularWeight: 482.674563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCCCC1)C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(CCC(C#N)(C1CCCCC1)C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C33H39FN2/c1-2-32(36(24-27-12-6-3-7-13-27)25-28-14-8-4-9-15-28)22-23-33(26-35,29-16-10-5-11-17-29)30-18-20-31(34)21-19-30/h3-4,6-9,12-15,18-21,29,32H,2,5,10-11,16-17,22-25H2,1H3