3-(5-iodanyl-2-methanoyl-4-methyl-1H-pyrrol-3-yl)propanenitrile

Systemtic Name: 3-(5-iodanyl-2-methanoyl-4-methyl-1H-pyrrol-3-yl)propanenitrile Openeye Name: 3-(2-formyl-5-iodo-4-methyl-1H-pyrrol-3-yl)propanenitrile CAS Name: 3-(2-formyl-5-iodo-4-methyl-1H-pyrrol-3-yl)propanenitrile IUPAC Name: 3-(2-formyl-5-iodo-4-methyl-1H-pyrrol-3-yl)propanenitrile Traditional Name: 3-(2-formyl-5-iodo-4-methyl-1H-pyrrol-3-yl)propionitrile Formula: C9H9IN2O MolecularWeight: 288.08503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC#N)C=O)I

Isomeric SMILES

CC1=C(NC(=C1CCC#N)C=O)I

InChI

InChI=1S/C9H9IN2O/c1-6-7(3-2-4-11)8(5-13)12-9(6)10/h5,12H,2-3H2,1H3