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

Systemtic Name: 4-[(E)-but-1-enyl]-2-cyclohepta-2,4,6-trien-1-yl-benzoic acid Openeye Name: 4-[(E)-but-1-enyl]-2-cyclohepta-2,4,6-trien-1-yl-benzoic acid CAS Name: 4-[(E)-but-1-enyl]-2-(1-cyclohepta-2,4,6-trienyl)benzoic acid IUPAC Name: 4-[(E)-but-1-enyl]-2-cyclohepta-2,4,6-trien-1-ylbenzoic acid Traditional Name: 4-[(E)-but-1-enyl]-2-cyclohepta-2,4,6-trien-1-yl-benzoic acid Formula: C18H18O2 MolecularWeight: 266.33432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O2/c1-2-3-8-14-11-12-16(18(19)20)17(13-14)15-9-6-4-5-7-10-15/h3-13,15H,2H2,1H3,(H,19,20)/b8-3+