1,3-di(hexadecanoyloxy)propan-2-yl 2-[(2,3-dimethylphenyl)amino]benzoate

Systemtic Name: 1,3-di(hexadecanoyloxy)propan-2-yl 2-[(2,3-dimethylphenyl)amino]benzoate Openeye Name: [2-hexadecanoyloxy-1-(hexadecanoyloxymethyl)ethyl] 2-(2,3-dimethylanilino)benzoate CAS Name: 2-(2,3-dimethylanilino)benzoic acid 1,3-bis(1-oxohexadecoxy)propan-2-yl ester IUPAC Name: 1,3-di(hexadecanoyloxy)propan-2-yl 2-(2,3-dimethylanilino)benzoate Traditional Name: 2-(2,3-dimethylanilino)benzoic acid [2-hexadecanoyloxy-1-(hexadecanoyloxymethyl)ethyl] ester Formula: C50H81NO6 MolecularWeight: 792.18124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)C1=CC=CC=C1NC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)C1=CC=CC=C1NC2=CC=CC(=C2C)C

InChI

InChI=1S/C50H81NO6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-38-48(52)55-40-44(41-56-49(53)39-30-28-26-24-22-20-18-16-14-12-10-8-6-2)57-50(54)45-35-31-32-36-47(45)51-46-37-33-34-42(3)43(46)4/h31-37,44,51H,5-30,38-41H2,1-4H3