4-[(E)-3-cyclohepta-2,4,6-trien-1-yl-3-methyl-but-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-cyclohepta-2,4,6-trien-1-yl-3-methyl-but-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-cyclohepta-2,4,6-trien-1-yl-3-methyl-but-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(1-cyclohepta-2,4,6-trienyl)-3-methylbut-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-cyclohepta-2,4,6-trien-1-yl-3-methylbut-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-cyclohepta-2,4,6-trien-1-yl-3-methyl-but-1-enyl]benzoic acid Formula: C19H20O2 MolecularWeight: 280.3609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=CC1=CC=C(C=C1)C(=O)O)C2C=CC=CC=C2

Isomeric SMILES

CC(C)(/C=C/C1=CC=C(C=C1)C(=O)O)C2C=CC=CC=C2

InChI

InChI=1S/C19H20O2/c1-19(2,17-7-5-3-4-6-8-17)14-13-15-9-11-16(12-10-15)18(20)21/h3-14,17H,1-2H3,(H,20,21)/b14-13+