4-[(E)-6-methyl-4-oxidanylidene-hept-2-en-2-yl]benzoic acid

Systemtic Name: 4-[(E)-6-methyl-4-oxidanylidene-hept-2-en-2-yl]benzoic acid Openeye Name: 4-[(E)-1,5-dimethyl-3-oxo-hex-1-enyl]benzoic acid CAS Name: 4-[(E)-6-methyl-4-oxohept-2-en-2-yl]benzoic acid IUPAC Name: 4-[(E)-6-methyl-4-oxohept-2-en-2-yl]benzoic acid Traditional Name: 4-[(E)-3-keto-1,5-dimethyl-hex-1-enyl]benzoic acid Formula: C15H18O3 MolecularWeight: 246.30162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18O3/c1-10(2)8-14(16)9-11(3)12-4-6-13(7-5-12)15(17)18/h4-7,9-10H,8H2,1-3H3,(H,17,18)/b11-9+