(E)-3-isoquinolin-4-ylprop-2-enal

Systemtic Name: (E)-3-isoquinolin-4-ylprop-2-enal Openeye Name: (E)-3-(4-isoquinolyl)prop-2-enal CAS Name: (E)-3-(4-isoquinolinyl)-2-propenal IUPAC Name: (E)-3-isoquinolin-4-ylprop-2-enal Traditional Name: (E)-3-(4-isoquinolyl)acrolein Formula: C12H9NO MolecularWeight: 183.20596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC=C2C=CC=O

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO/c14-7-3-5-11-9-13-8-10-4-1-2-6-12(10)11/h1-9H/b5-3+