O2-ethyl O1-(4-methylpentyl) 3-ethylbenzene-1,2-dicarboxylate

Systemtic Name: O2-ethyl O1-(4-methylpentyl) 3-ethylbenzene-1,2-dicarboxylate Openeye Name: O2-ethyl O1-isohexyl 3-ethylbenzene-1,2-dicarboxylate CAS Name: 3-ethylbenzene-1,2-dicarboxylic acid O2-ethyl ester O1-(4-methylpentyl) ester IUPAC Name: 2-O-ethyl 1-O-(4-methylpentyl) 3-ethylbenzene-1,2-dicarboxylate Traditional Name: 3-ethylbenzene-1,2-dicarboxylic acid O2-ethyl ester O1-isohexyl ester Formula: C18H26O4 MolecularWeight: 306.39664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1C(=O)OCC)C(=O)OCCCC(C)C

Isomeric SMILES

CCC1=CC=CC(=C1C(=O)OCC)C(=O)OCCCC(C)C

InChI

InChI=1S/C18H26O4/c1-5-14-10-7-11-15(16(14)18(20)21-6-2)17(19)22-12-8-9-13(3)4/h7,10-11,13H,5-6,8-9,12H2,1-4H3