2-(3-methylbut-2-enyl)-2-[1-(4-methylphenyl)ethyl]propanedioic acid

Systemtic Name: 2-(3-methylbut-2-enyl)-2-[1-(4-methylphenyl)ethyl]propanedioic acid Openeye Name: 2-(3-methylbut-2-enyl)-2-[1-(p-tolyl)ethyl]propanedioic acid CAS Name: 2-(3-methylbut-2-enyl)-2-[1-(4-methylphenyl)ethyl]propanedioic acid IUPAC Name: 2-(3-methylbut-2-enyl)-2-[1-(4-methylphenyl)ethyl]propanedioic acid Traditional Name: 2-(3-methylbut-2-enyl)-2-[1-(p-tolyl)ethyl]malonic acid Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O4/c1-11(2)9-10-17(15(18)19,16(20)21)13(4)14-7-5-12(3)6-8-14/h5-9,13H,10H2,1-4H3,(H,18,19)(H,20,21)