2-[2,6-bis(fluoranyl)phenyl]-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-heptanenitrile

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-heptanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-(2,6-difluorophenyl)-2-isopropyl-heptanenitrile CAS Name: 2-(2,6-difluorophenyl)-5-[(phenylmethyl)-propylamino]-2-propan-2-ylheptanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-(2,6-difluorophenyl)-2-propan-2-ylheptanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-(2,6-difluorophenyl)-2-isopropyl-enanthonitrile Formula: C26H34F2N2 MolecularWeight: 412.558366

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(CC)CCC(C#N)(C2=C(C=CC=C2F)F)C(C)C

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(CC)CCC(C#N)(C2=C(C=CC=C2F)F)C(C)C

InChI

InChI=1S/C26H34F2N2/c1-5-17-30(18-21-11-8-7-9-12-21)22(6-2)15-16-26(19-29,20(3)4)25-23(27)13-10-14-24(25)28/h7-14,20,22H,5-6,15-18H2,1-4H3