5-[[[3,4-diethoxy-5-(ethylamino)-1,6-diphenyl-hexan-2-yl]amino]methyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 5-[[[3,4-diethoxy-5-(ethylamino)-1,6-diphenyl-hexan-2-yl]amino]methyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 5-[[[1-benzyl-2,3-diethoxy-4-(ethylamino)-5-phenyl-pentyl]amino]methyl]-2-fluoro-benzonitrile CAS Name: 5-[[[3,4-diethoxy-5-(ethylamino)-1,6-diphenylhexan-2-yl]amino]methyl]-2-fluorobenzonitrile IUPAC Name: 5-[[[3,4-diethoxy-5-(ethylamino)-1,6-diphenylhexan-2-yl]amino]methyl]-2-fluorobenzonitrile Traditional Name: 5-[[[1-benzyl-2,3-diethoxy-4-(ethylamino)-5-phenyl-pentyl]amino]methyl]-2-fluoro-benzonitrile Formula: C32H40FN3O2 MolecularWeight: 517.677303

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)NCC3=CC(=C(C=C3)F)C#N)OCC)OCC

Isomeric SMILES

CCNC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)NCC3=CC(=C(C=C3)F)C#N)OCC)OCC

InChI

InChI=1S/C32H40FN3O2/c1-4-35-29(20-24-13-9-7-10-14-24)31(37-5-2)32(38-6-3)30(21-25-15-11-8-12-16-25)36-23-26-17-18-28(33)27(19-26)22-34/h7-19,29-32,35-36H,4-6,20-21,23H2,1-3H3