benzaldehyde; (E)-3-phenylprop-2-enal

Systemtic Name: benzaldehyde; (E)-3-phenylprop-2-enal Openeye Name: benzaldehyde; (E)-3-phenylprop-2-enal CAS Name: benzaldehyde; (E)-3-phenyl-2-propenal IUPAC Name: benzaldehyde; (E)-3-phenylprop-2-enal Traditional Name: benzaldehyde; (E)-3-phenylacrolein Formula: C16H14O2 MolecularWeight: 238.28116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8O.C7H6O/c10-8-4-7-9-5-2-1-3-6-9;8-6-7-4-2-1-3-5-7/h1-8H;1-6H/b7-4+;