3-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 3-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethoxy]benzonitrile Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)COC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)COC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H16N2O3/c1-10-16(12(3)20)11(2)19-17(10)15(21)9-22-14-6-4-5-13(7-14)8-18/h4-7,19H,9H2,1-3H3