O1-butyl O10-(phenylmethyl) decanedioate

Systemtic Name: O1-butyl O10-(phenylmethyl) decanedioate Openeye Name: O10-benzyl O1-butyl decanedioate CAS Name: decanedioic acid O1-butyl ester O10-(phenylmethyl) ester IUPAC Name: 10-O-benzyl 1-O-butyl decanedioate Traditional Name: sebacic acid O10-benzyl ester O1-butyl ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCCCCCCCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)CCCCCCCCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H32O4/c1-2-3-17-24-20(22)15-11-6-4-5-7-12-16-21(23)25-18-19-13-9-8-10-14-19/h8-10,13-14H,2-7,11-12,15-18H2,1H3