ethyl (8E)-2-oxidanylidene-8-(phenylmethylidene)-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl (8E)-2-oxidanylidene-8-(phenylmethylidene)-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylate Openeye Name: ethyl (8E)-8-benzylidene-2-oxo-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylate CAS Name: (8E)-2-oxo-8-(phenylmethylene)-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (8E)-8-benzylidene-2-oxo-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylate Traditional Name: (8E)-8-benzal-2-keto-6,7-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2CCC(=CC3=CC=CC=C3)C2=NC1=O

Isomeric SMILES

CCOC(=O)C1=CN2CC/C(=C\C3=CC=CC=C3)/C2=NC1=O

InChI

InChI=1S/C17H16N2O3/c1-2-22-17(21)14-11-19-9-8-13(15(19)18-16(14)20)10-12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3/b13-10+