5-(2-methylpropyl)-2-[(Z)-1-oxidanyl-1-oxidanylidene-pent-2-en-2-yl]benzoic acid

Systemtic Name: 5-(2-methylpropyl)-2-[(Z)-1-oxidanyl-1-oxidanylidene-pent-2-en-2-yl]benzoic acid Openeye Name: 2-[(Z)-1-carboxybut-1-enyl]-5-isobutyl-benzoic acid CAS Name: 2-[(Z)-1-hydroxy-1-oxopent-2-en-2-yl]-5-(2-methylpropyl)benzoic acid IUPAC Name: 2-[(Z)-1-hydroxy-1-oxopent-2-en-2-yl]-5-(2-methylpropyl)benzoic acid Traditional Name: 2-[(Z)-1-carboxybut-1-enyl]-5-isobutyl-benzoic acid Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC/C=C(/C1=C(C=C(C=C1)CC(C)C)C(=O)O)\C(=O)O

InChI

InChI=1S/C16H20O4/c1-4-5-13(15(17)18)12-7-6-11(8-10(2)3)9-14(12)16(19)20/h5-7,9-10H,4,8H2,1-3H3,(H,17,18)(H,19,20)/b13-5-