methyl 2-[[[3,5-di(docosoxy)phenyl]-diphenyl-methyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[[[3,5-di(docosoxy)phenyl]-diphenyl-methyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[[[3,5-di(docosoxy)phenyl]-diphenyl-methyl]amino]-3-hydroxy-propanoate CAS Name: 2-[[[3,5-di(docosoxy)phenyl]-diphenylmethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[[[3,5-di(docosoxy)phenyl]-diphenylmethyl]amino]-3-hydroxypropanoate Traditional Name: 2-[[(3,5-dibehenyloxyphenyl)-diphenyl-methyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C67H111NO5 MolecularWeight: 1010.60194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CO)C(=O)OC)OCCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CO)C(=O)OC)OCCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C67H111NO5/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-48-54-72-63-56-62(67(60-50-44-42-45-51-60,61-52-46-43-47-53-61)68-65(59-69)66(70)71-3)57-64(58-63)73-55-49-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h42-47,50-53,56-58,65,68-69H,4-41,48-49,54-55,59H2,1-3H3