1,3-dihexadecoxypropan-2-yl 4-(diethylamino)butanoate

Systemtic Name: 1,3-dihexadecoxypropan-2-yl 4-(diethylamino)butanoate Openeye Name: [2-hexadecoxy-1-(hexadecoxymethyl)ethyl] 4-(diethylamino)butanoate CAS Name: 4-(diethylamino)butanoic acid 1,3-dihexadecoxypropan-2-yl ester IUPAC Name: 1,3-dihexadecoxypropan-2-yl 4-(diethylamino)butanoate Traditional Name: 4-(diethylamino)butyric acid [2-cetyloxy-1-(cetyloxymethyl)ethyl] ester Formula: C43H87NO4 MolecularWeight: 682.15518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COCCCCCCCCCCCCCCCC)OC(=O)CCCN(CC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COCCCCCCCCCCCCCCCC)OC(=O)CCCN(CC)CC

InChI

InChI=1S/C43H87NO4/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-38-46-40-42(48-43(45)36-35-37-44(7-3)8-4)41-47-39-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h42H,5-41H2,1-4H3