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

Systemtic Name: O2-butyl O1-(4-methylpentyl) 4-ethylbenzene-1,2-dicarboxylate Openeye Name: O2-butyl O1-isohexyl 4-ethylbenzene-1,2-dicarboxylate CAS Name: 4-ethylbenzene-1,2-dicarboxylic acid O2-butyl ester O1-(4-methylpentyl) ester IUPAC Name: 2-O-butyl 1-O-(4-methylpentyl) 4-ethylbenzene-1,2-dicarboxylate Traditional Name: 4-ethylbenzene-1,2-dicarboxylic acid O2-butyl ester O1-isohexyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O4/c1-5-7-12-23-20(22)18-14-16(6-2)10-11-17(18)19(21)24-13-8-9-15(3)4/h10-11,14-15H,5-9,12-13H2,1-4H3