O1-butyl O10-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)ethanoyl]phenyl] decanedioate

Systemtic Name: O1-butyl O10-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)ethanoyl]phenyl] decanedioate Openeye Name: O1-butyl O10-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)acetyl]phenyl] decanedioate CAS Name: decanedioic acid O1-butyl ester O10-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)-1-oxoethyl]phenyl] ester IUPAC Name: 1-O-butyl 10-O-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)acetyl]phenyl] decanedioate Traditional Name: sebacic acid O1-butyl ester O10-[3,5-dimethoxy-2-[2-(4-methoxyphenyl)acetyl]phenyl] ester Formula: C31H42O8 MolecularWeight: 542.66038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCCCCCCCC(=O)OC1=C(C(=CC(=C1)OC)OC)C(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC(=O)CCCCCCCCC(=O)OC1=C(C(=CC(=C1)OC)OC)C(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C31H42O8/c1-5-6-19-38-29(33)13-11-9-7-8-10-12-14-30(34)39-28-22-25(36-3)21-27(37-4)31(28)26(32)20-23-15-17-24(35-2)18-16-23/h15-18,21-22H,5-14,19-20H2,1-4H3