(3R,4R)-3-[[bis(phenylmethyl)amino]methyl]-1-phenyl-hept-1-yn-4-ol

Systemtic Name: (3R,4R)-3-[[bis(phenylmethyl)amino]methyl]-1-phenyl-hept-1-yn-4-ol Openeye Name: (3R,4R)-3-[(dibenzylamino)methyl]-1-phenyl-hept-1-yn-4-ol CAS Name: (3R,4R)-3-[[bis(phenylmethyl)amino]methyl]-1-phenyl-1-heptyn-4-ol IUPAC Name: (3R,4R)-3-[(dibenzylamino)methyl]-1-phenylhept-1-yn-4-ol Traditional Name: (3R,4R)-3-[(dibenzylamino)methyl]-1-phenyl-hept-1-yn-4-ol Formula: C28H31NO MolecularWeight: 397.55184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CN(CC1=CC=CC=C1)CC2=CC=CC=C2)C#CC3=CC=CC=C3)O

Isomeric SMILES

CCC[C@H]([C@@H](CN(CC1=CC=CC=C1)CC2=CC=CC=C2)C#CC3=CC=CC=C3)O

InChI

InChI=1S/C28H31NO/c1-2-12-28(30)27(20-19-24-13-6-3-7-14-24)23-29(21-25-15-8-4-9-16-25)22-26-17-10-5-11-18-26/h3-11,13-18,27-28,30H,2,12,21-23H2,1H3/t27-,28-/m1/s1