2-but-3-enyl-2-[(3-tert-butyl-5-carboxy-phenyl)methyl]propanedioic acid

Systemtic Name: 2-but-3-enyl-2-[(3-tert-butyl-5-carboxy-phenyl)methyl]propanedioic acid Openeye Name: 2-but-3-enyl-2-[(3-tert-butyl-5-carboxy-phenyl)methyl]propanedioic acid CAS Name: 2-but-3-enyl-2-[(3-tert-butyl-5-carboxyphenyl)methyl]propanedioic acid IUPAC Name: 2-but-3-enyl-2-[(3-tert-butyl-5-carboxyphenyl)methyl]propanedioic acid Traditional Name: 2-but-3-enyl-2-(3-tert-butyl-5-carboxy-benzyl)malonic acid Formula: C19H24O6 MolecularWeight: 348.39026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24O6/c1-5-6-7-19(16(22)23,17(24)25)11-12-8-13(15(20)21)10-14(9-12)18(2,3)4/h5,8-10H,1,6-7,11H2,2-4H3,(H,20,21)(H,22,23)(H,24,25)