O1-hexyl O6-(phenylmethyl) hexanedioate

Systemtic Name: O1-hexyl O6-(phenylmethyl) hexanedioate Openeye Name: O6-benzyl O1-hexyl hexanedioate CAS Name: hexanedioic acid O1-hexyl ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-hexyl hexanedioate Traditional Name: adipic acid O6-benzyl ester O1-hexyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCOC(=O)CCCCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H28O4/c1-2-3-4-10-15-22-18(20)13-8-9-14-19(21)23-16-17-11-6-5-7-12-17/h5-7,11-12H,2-4,8-10,13-16H2,1H3