2,4-di(hexan-3-yl)benzene-1,3-dicarboxylate

Systemtic Name: 2,4-di(hexan-3-yl)benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(1-ethylbutyl)benzene-1,3-dicarboxylate CAS Name: 2,4-di(hexan-3-yl)benzene-1,3-dicarboxylate IUPAC Name: 2,4-di(hexan-3-yl)benzene-1,3-dicarboxylate Traditional Name: 2,4-bis(1-ethylbutyl)isophthalate Formula: C20H28O4-2 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C1=C(C(=C(C=C1)C(=O)[O-])C(CC)CCC)C(=O)[O-]

Isomeric SMILES

CCCC(CC)C1=C(C(=C(C=C1)C(=O)[O-])C(CC)CCC)C(=O)[O-]

InChI

InChI=1S/C20H30O4/c1-5-9-13(7-3)15-11-12-16(19(21)22)17(18(15)20(23)24)14(8-4)10-6-2/h11-14H,5-10H2,1-4H3,(H,21,22)(H,23,24)/p-2