O5-dodecanoyl O1-(9-octylicosan-9-yl) 2-azanylpentanedioate

Systemtic Name: O5-dodecanoyl O1-(9-octylicosan-9-yl) 2-azanylpentanedioate Openeye Name: O1-(1,1-dioctyldodecyl) O5-dodecanoyl 2-aminopentanedioate CAS Name: 2-aminopentanedioic acid O1-(9-octyleicosan-9-yl) ester O5-(1-oxododecyl) ester IUPAC Name: 5-O-dodecanoyl 1-O-(9-octylicosan-9-yl) 2-aminopentanedioate Traditional Name: 2-aminoglutaric acid O1-(1,1-dioctyldodecyl) ester O5-lauroyl ester Formula: C45H87NO5 MolecularWeight: 722.17598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(=O)CCC(C(=O)OC(CCCCCCCC)(CCCCCCCC)CCCCCCCCCCC)N

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(=O)CCC(C(=O)OC(CCCCCCCC)(CCCCCCCC)CCCCCCCCCCC)N

InChI

InChI=1S/C45H87NO5/c1-5-9-13-17-21-23-25-27-31-35-42(47)50-43(48)37-36-41(46)44(49)51-45(38-32-28-19-15-11-7-3,39-33-29-20-16-12-8-4)40-34-30-26-24-22-18-14-10-6-2/h41H,5-40,46H2,1-4H3