dimethyl 7-(hydroxymethyl)-8-(8-methoxy-8-oxidanylidene-octanoyl)oxy-pentadecanedioate

Systemtic Name: dimethyl 7-(hydroxymethyl)-8-(8-methoxy-8-oxidanylidene-octanoyl)oxy-pentadecanedioate Openeye Name: dimethyl 7-(hydroxymethyl)-8-(8-methoxy-8-oxo-octanoyl)oxy-pentadecanedioate CAS Name: 7-(hydroxymethyl)-8-(8-methoxy-1,8-dioxooctoxy)pentadecanedioic acid dimethyl ester IUPAC Name: dimethyl 7-(hydroxymethyl)-8-(8-methoxy-8-oxooctanoyl)oxypentadecanedioate Traditional Name: 8-(8-keto-8-methoxy-octanoyl)oxy-7-methylol-pentadecanedioic acid dimethyl ester Formula: C27H48O9 MolecularWeight: 516.66462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(C(CCCCCC(=O)OC)CO)OC(=O)CCCCCCC(=O)OC

Isomeric SMILES

COC(=O)CCCCCCC(C(CCCCCC(=O)OC)CO)OC(=O)CCCCCCC(=O)OC

InChI

InChI=1S/C27H48O9/c1-33-24(29)17-11-5-4-10-16-23(22(21-28)15-9-8-14-19-26(31)35-3)36-27(32)20-13-7-6-12-18-25(30)34-2/h22-23,28H,4-21H2,1-3H3