O2-butyl O1-(4-methylpentyl) 3-methylbenzene-1,2-dicarboxylate

Systemtic Name: O2-butyl O1-(4-methylpentyl) 3-methylbenzene-1,2-dicarboxylate Openeye Name: O2-butyl O1-isohexyl 3-methylbenzene-1,2-dicarboxylate CAS Name: 3-methylbenzene-1,2-dicarboxylic acid O2-butyl ester O1-(4-methylpentyl) ester IUPAC Name: 2-O-butyl 1-O-(4-methylpentyl) 3-methylbenzene-1,2-dicarboxylate Traditional Name: 3-methylbenzene-1,2-dicarboxylic acid O2-butyl ester O1-isohexyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CC=C1C)C(=O)OCCCC(C)C

Isomeric SMILES

CCCCOC(=O)C1=C(C=CC=C1C)C(=O)OCCCC(C)C

InChI

InChI=1S/C19H28O4/c1-5-6-12-23-19(21)17-15(4)10-7-11-16(17)18(20)22-13-8-9-14(2)3/h7,10-11,14H,5-6,8-9,12-13H2,1-4H3