2,4-bis(2-methylbutyl)benzene-1,3-dicarboxylate

Systemtic Name: 2,4-bis(2-methylbutyl)benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(2-methylbutyl)benzene-1,3-dicarboxylate CAS Name: 2,4-bis(2-methylbutyl)benzene-1,3-dicarboxylate IUPAC Name: 2,4-bis(2-methylbutyl)benzene-1,3-dicarboxylate Traditional Name: 2,4-bis(2-methylbutyl)isophthalate Formula: C18H24O4-2 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(C(=C(C=C1)C(=O)[O-])CC(C)CC)C(=O)[O-]

Isomeric SMILES

CCC(C)CC1=C(C(=C(C=C1)C(=O)[O-])CC(C)CC)C(=O)[O-]

InChI

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