O1-butyl O2-(phenylmethyl) benzene-1,2-dicarboxylate; dihexyl hexanedioate

Systemtic Name: O1-butyl O2-(phenylmethyl) benzene-1,2-dicarboxylate; dihexyl hexanedioate Openeye Name: O2-benzyl O1-butyl benzene-1,2-dicarboxylate; dihexyl hexanedioate CAS Name: benzene-1,2-dicarboxylic acid O1-butyl ester O2-(phenylmethyl) ester; hexanedioic acid dihexyl ester IUPAC Name: 2-O-benzyl 1-O-butyl benzene-1,2-dicarboxylate; dihexyl hexanedioate Traditional Name: adipic acid dihexyl ester; benzene-1,2-dicarboxylic acid O2-benzyl ester O1-butyl ester Formula: C37H54O8 MolecularWeight: 626.81986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCCC(=O)OCCCCCC.CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCOC(=O)CCCCC(=O)OCCCCCC.CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H20O4.C18H34O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15;1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h4-12H,2-3,13-14H2,1H3;3-16H2,1-2H3