1H-indole; (E)-3-phenylprop-2-enal

Systemtic Name: 1H-indole; (E)-3-phenylprop-2-enal Openeye Name: indole; (E)-3-phenylprop-2-enal CAS Name: 1H-indole; (E)-3-phenyl-2-propenal IUPAC Name: 1H-indole; (E)-3-phenylprop-2-enal Traditional Name: indole; (E)-3-phenylacrolein Formula: C17H15NO MolecularWeight: 249.3071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC=O.C1=CC=C2C(=C1)C=CN2

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C=O.C1=CC=C2C(=C1)C=CN2

InChI

InChI=1S/C9H8O.C8H7N/c10-8-4-7-9-5-2-1-3-6-9;1-2-4-8-7(3-1)5-6-9-8/h1-8H;1-6,9H/b7-4+;