[2-[[3-methyl-2-[(triphenylmethyl)amino]butanoyl]oxymethyl]-4-oxidanylidene-butyl] octadecanoate

Systemtic Name: [2-[[3-methyl-2-[(triphenylmethyl)amino]butanoyl]oxymethyl]-4-oxidanylidene-butyl] octadecanoate Openeye Name: [2-[[3-methyl-2-(tritylamino)butanoyl]oxymethyl]-4-oxo-butyl] octadecanoate CAS Name: octadecanoic acid [2-[[3-methyl-1-oxo-2-[(triphenylmethyl)amino]butoxy]methyl]-4-oxobutyl] ester IUPAC Name: [2-[[3-methyl-2-(tritylamino)butanoyl]oxymethyl]-4-oxobutyl] octadecanoate Traditional Name: stearic acid [4-keto-2-[[3-methyl-2-(tritylamino)butanoyl]oxymethyl]butyl] ester Formula: C47H67NO5 MolecularWeight: 726.03858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CC=O)COC(=O)C(C(C)C)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CC=O)COC(=O)C(C(C)C)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C47H67NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-34-44(50)52-37-40(35-36-49)38-53-46(51)45(39(2)3)48-47(41-28-21-18-22-29-41,42-30-23-19-24-31-42)43-32-25-20-26-33-43/h18-26,28-33,36,39-40,45,48H,4-17,27,34-35,37-38H2,1-3H3