[(E,2S,3S)-2-[(diphenylmethylidene)amino]-1-oxidanyl-octadec-4-en-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [(E,2S,3S)-2-[(diphenylmethylidene)amino]-1-oxidanyl-octadec-4-en-3-yl] 2,2-dimethylpropanoate Openeye Name: [(E,1S)-1-[(1S)-1-(benzhydrylideneamino)-2-hydroxy-ethyl]hexadec-2-enyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(E,2S,3S)-2-[(diphenylmethylene)amino]-1-hydroxyoctadec-4-en-3-yl] ester IUPAC Name: [(E,2S,3S)-2-(benzhydrylideneamino)-1-hydroxyoctadec-4-en-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(E,1S)-1-[(1S)-1-(benzhydrylideneamino)-2-hydroxy-ethyl]hexadec-2-enyl] ester Formula: C36H53NO3 MolecularWeight: 547.81092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)N=C(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@@H]([C@H](CO)N=C(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C(C)(C)C

InChI

InChI=1S/C36H53NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-23-28-33(40-35(39)36(2,3)4)32(29-38)37-34(30-24-19-17-20-25-30)31-26-21-18-22-27-31/h17-28,32-33,38H,5-16,29H2,1-4H3/b28-23+/t32-,33-/m0/s1