2,4-bis(2-ethylbutyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 2,4-bis(2-ethylbutyl)benzene-1,3-dicarboxylic acid Openeye Name: 2,4-bis(2-ethylbutyl)benzene-1,3-dicarboxylic acid CAS Name: 2,4-bis(2-ethylbutyl)benzene-1,3-dicarboxylic acid IUPAC Name: 2,4-bis(2-ethylbutyl)benzene-1,3-dicarboxylic acid Traditional Name: 2,4-bis(2-ethylbutyl)isophthalic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC1=C(C(=C(C=C1)C(=O)O)CC(CC)CC)C(=O)O

Isomeric SMILES

CCC(CC)CC1=C(C(=C(C=C1)C(=O)O)CC(CC)CC)C(=O)O

InChI

InChI=1S/C20H30O4/c1-5-13(6-2)11-15-9-10-16(19(21)22)17(18(15)20(23)24)12-14(7-3)8-4/h9-10,13-14H,5-8,11-12H2,1-4H3,(H,21,22)(H,23,24)