12-(tritriacontan-17-ylamino)dodecan-3-yl nonanoate

Systemtic Name: 12-(tritriacontan-17-ylamino)dodecan-3-yl nonanoate Openeye Name: [1-ethyl-10-(1-hexadecylheptadecylamino)decyl] nonanoate CAS Name: nonanoic acid 12-(tritriacontan-17-ylamino)dodecan-3-yl ester IUPAC Name: 12-(tritriacontan-17-ylamino)dodecan-3-yl nonanoate Traditional Name: pelargonic acid [10-(1-cetylheptadecylamino)-1-ethyl-decyl] ester Formula: C54H109NO2 MolecularWeight: 804.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)NCCCCCCCCCC(CC)OC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)NCCCCCCCCCC(CC)OC(=O)CCCCCCCC

InChI

InChI=1S/C54H109NO2/c1-5-9-12-15-18-20-22-24-26-28-30-33-37-42-47-52(48-43-38-34-31-29-27-25-23-21-19-16-13-10-6-2)55-51-46-41-36-32-35-39-44-49-53(8-4)57-54(56)50-45-40-17-14-11-7-3/h52-53,55H,5-51H2,1-4H3