dibutyl 3-tert-butylbenzene-1,2-dicarboxylate

Systemtic Name: dibutyl 3-tert-butylbenzene-1,2-dicarboxylate Openeye Name: dibutyl 3-tert-butylbenzene-1,2-dicarboxylate CAS Name: 3-tert-butylbenzene-1,2-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl 3-tert-butylbenzene-1,2-dicarboxylate Traditional Name: 3-tert-butylbenzene-1,2-dicarboxylic acid dibutyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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