(3,3a-dicyano-1-ethanoyl-2,4-dimethyl-6-oxidanylidene-6a-phenyl-furo[3,4-b]pyrrol-4-yl) ethanoate

Systemtic Name: (3,3a-dicyano-1-ethanoyl-2,4-dimethyl-6-oxidanylidene-6a-phenyl-furo[3,4-b]pyrrol-4-yl) ethanoate Openeye Name: (1-acetyl-3,3a-dicyano-2,4-dimethyl-6-oxo-6a-phenyl-furo[3,4-b]pyrrol-4-yl) acetate CAS Name: acetic acid (1-acetyl-3,3a-dicyano-2,4-dimethyl-6-oxo-6a-phenyl-4-furo[3,4-b]pyrrolyl) ester IUPAC Name: (1-acetyl-3,3a-dicyano-2,4-dimethyl-6-oxo-6a-phenylfuro[3,4-b]pyrrol-4-yl) acetate Traditional Name: acetic acid (1-acetyl-3,3a-dicyano-6-keto-2,4-dimethyl-6a-phenyl-furo[3,4-b]pyrrol-4-yl) ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2(C(OC(=O)C2(N1C(=O)C)C3=CC=CC=C3)(C)OC(=O)C)C#N)C#N

Isomeric SMILES

CC1=C(C2(C(OC(=O)C2(N1C(=O)C)C3=CC=CC=C3)(C)OC(=O)C)C#N)C#N

InChI

InChI=1S/C20H17N3O5/c1-12-16(10-21)19(11-22)18(4,27-14(3)25)28-17(26)20(19,23(12)13(2)24)15-8-6-5-7-9-15/h5-9H,1-4H3