[(1S,2S,3S,5S)-1-bromanyl-1-phenyl-2,3-bis(phenylmethoxy)tetradecan-5-yl]-methyl-cyanamide

Systemtic Name: [(1S,2S,3S,5S)-1-bromanyl-1-phenyl-2,3-bis(phenylmethoxy)tetradecan-5-yl]-methyl-cyanamide Openeye Name: [(1S)-1-[(2S,3S,4S)-2,3-dibenzyloxy-4-bromo-4-phenyl-butyl]decyl]-methyl-cyanamide CAS Name: [(1S,2S,3S,5S)-1-bromo-1-phenyl-2,3-bis(phenylmethoxy)tetradecan-5-yl]-methylcyanamide IUPAC Name: [(1S,2S,3S,5S)-1-bromo-1-phenyl-2,3-bis(phenylmethoxy)tetradecan-5-yl]-methylcyanamide Traditional Name: [(1S)-1-[(2S,3S,4S)-2,3-dibenzoxy-4-bromo-4-phenyl-butyl]decyl]-methyl-cyanamide Formula: C36H47BrN2O2 MolecularWeight: 619.67458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CC(C(C(C1=CC=CC=C1)Br)OCC2=CC=CC=C2)OCC3=CC=CC=C3)N(C)C#N

Isomeric SMILES

CCCCCCCCC[C@@H](C[C@@H]([C@@H]([C@H](C1=CC=CC=C1)Br)OCC2=CC=CC=C2)OCC3=CC=CC=C3)N(C)C#N

InChI

InChI=1S/C36H47BrN2O2/c1-3-4-5-6-7-8-18-25-33(39(2)29-38)26-34(40-27-30-19-12-9-13-20-30)36(35(37)32-23-16-11-17-24-32)41-28-31-21-14-10-15-22-31/h9-17,19-24,33-36H,3-8,18,25-28H2,1-2H3/t33-,34-,35-,36-/m0/s1