prop-2-enal dibenzoate

Systemtic Name: prop-2-enal dibenzoate Openeye Name: prop-2-enal dibenzoate CAS Name: 2-propenal dibenzoate IUPAC Name: prop-2-enal dibenzoate Traditional Name: acrolein dibenzoate Formula: C17H14O5-2 MolecularWeight: 298.29006

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=O.C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

C=CC=O.C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/2C7H6O2.C3H4O/c2*8-7(9)6-4-2-1-3-5-6;1-2-3-4/h2*1-5H,(H,8,9);2-3H,1H2/p-2