4-[tert-butyl-(phenylmethyl)amino]-1-(3-fluorophenyl)-1-phenyl-but-2-yn-1-ol

Systemtic Name: 4-[tert-butyl-(phenylmethyl)amino]-1-(3-fluorophenyl)-1-phenyl-but-2-yn-1-ol Openeye Name: 4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenyl-but-2-yn-1-ol CAS Name: 4-[tert-butyl-(phenylmethyl)amino]-1-(3-fluorophenyl)-1-phenyl-2-butyn-1-ol IUPAC Name: 4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol Traditional Name: 4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenyl-but-2-yn-1-ol Formula: C27H28FNO MolecularWeight: 401.515723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC#CC(C1=CC=CC=C1)(C2=CC(=CC=C2)F)O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N(CC#CC(C1=CC=CC=C1)(C2=CC(=CC=C2)F)O)CC3=CC=CC=C3

InChI

InChI=1S/C27H28FNO/c1-26(2,3)29(21-22-12-6-4-7-13-22)19-11-18-27(30,23-14-8-5-9-15-23)24-16-10-17-25(28)20-24/h4-10,12-17,20,30H,19,21H2,1-3H3