O7,O7-ditert-butyl O1-methyl 11-acetyloxy-1-methyl-hexadecane-1,7,7-tricarboxylate

Systemtic Name: O7,O7-ditert-butyl O1-methyl 11-acetyloxy-1-methyl-hexadecane-1,7,7-tricarboxylate Openeye Name: O7,O7-ditert-butyl O1-methyl 11-acetoxy-1-methyl-hexadecane-1,7,7-tricarboxylate CAS Name: 11-acetyloxy-1-methylhexadecane-1,7,7-tricarboxylic acid O7,O7-ditert-butyl ester O1-methyl ester IUPAC Name: 7-O,7-O-ditert-butyl 1-O-methyl 11-acetyloxy-1-methylhexadecane-1,7,7-tricarboxylate Traditional Name: 11-acetoxy-1-methyl-hexadecane-1,7,7-tricarboxylic acid O7,O7-ditert-butyl ester O1-methyl ester Formula: C31H56O8 MolecularWeight: 556.77154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCC(C)C(=O)OC)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CCCCCC(C)C(=O)OC)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)OC(=O)C

InChI

InChI=1S/C31H56O8/c1-11-12-14-19-25(37-24(3)32)20-17-22-31(27(34)38-29(4,5)6,28(35)39-30(7,8)9)21-16-13-15-18-23(2)26(33)36-10/h23,25H,11-22H2,1-10H3