(E)-3-[6-[(E)-3-oxidanylideneprop-1-enyl]cyclohepta-1,3,5-trien-1-yl]prop-2-enal

Systemtic Name: (E)-3-[6-[(E)-3-oxidanylideneprop-1-enyl]cyclohepta-1,3,5-trien-1-yl]prop-2-enal Openeye Name: (E)-3-[6-[(E)-3-oxoprop-1-enyl]cyclohepta-1,3,5-trien-1-yl]prop-2-enal CAS Name: (E)-3-[6-[(E)-3-oxoprop-1-enyl]-1-cyclohepta-1,3,5-trienyl]-2-propenal IUPAC Name: (E)-3-[6-[(E)-3-oxoprop-1-enyl]cyclohepta-1,3,5-trien-1-yl]prop-2-enal Traditional Name: (E)-3-[6-[(E)-3-ketoprop-1-enyl]cyclohepta-1,3,5-trien-1-yl]acrolein Formula: C13H12O2 MolecularWeight: 200.23318

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=CC=C1C=CC=O)C=CC=O

Isomeric SMILES

C1C(=CC=CC=C1/C=C/C=O)/C=C/C=O

InChI

InChI=1S/C13H12O2/c14-9-3-7-12-5-1-2-6-13(11-12)8-4-10-15/h1-10H,11H2/b7-3+,8-4+