diethyl 8-acetyloxy-3-cyano-6-ethanoyl-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylate

Systemtic Name: diethyl 8-acetyloxy-3-cyano-6-ethanoyl-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylate Openeye Name: diethyl 8-acetoxy-6-acetyl-3-cyano-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylate CAS Name: 6-acetyl-8-acetyloxy-3-cyano-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-acetyl-8-acetyloxy-3-cyano-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylate Traditional Name: 8-acetoxy-6-acetyl-3-cyano-1,7-dihydropyrazolo[1,5-a][1,3]diazepine-7,8-dicarboxylic acid diethyl ester Formula: C18H20N4O7 MolecularWeight: 404.374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=CN=C2C(=CNN2C1(C(=O)OCC)OC(=O)C)C#N)C(=O)C

Isomeric SMILES

CCOC(=O)C1C(=CN=C2C(=CNN2C1(C(=O)OCC)OC(=O)C)C#N)C(=O)C

InChI

InChI=1S/C18H20N4O7/c1-5-27-16(25)14-13(10(3)23)9-20-15-12(7-19)8-21-22(15)18(14,29-11(4)24)17(26)28-6-2/h8-9,14,21H,5-6H2,1-4H3