2-cyclopropyl-2-(4-fluorophenyl)-5-[(phenylmethyl)-propyl-amino]heptanenitrile

Systemtic Name: 2-cyclopropyl-2-(4-fluorophenyl)-5-[(phenylmethyl)-propyl-amino]heptanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-cyclopropyl-2-(4-fluorophenyl)heptanenitrile CAS Name: 2-cyclopropyl-2-(4-fluorophenyl)-5-[(phenylmethyl)-propylamino]heptanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-cyclopropyl-2-(4-fluorophenyl)heptanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-cyclopropyl-2-(4-fluorophenyl)enanthonitrile Formula: C26H33FN2 MolecularWeight: 392.552023

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(CC)CCC(C#N)(C2CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(CC)CCC(C#N)(C2CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C26H33FN2/c1-3-18-29(19-21-8-6-5-7-9-21)25(4-2)16-17-26(20-28,22-10-11-22)23-12-14-24(27)15-13-23/h5-9,12-15,22,25H,3-4,10-11,16-19H2,1-2H3