diethyl 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylate

Systemtic Name: diethyl 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylate Openeye Name: diethyl 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylate CAS Name: 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylate Traditional Name: 9-cyano-7,8-dimethyl-4,5-dihydro-1H-pyrrolo[1,2-a][1,3]diazepine-3,5-dicarboxylic acid diethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=CNC2=C(C(=C(N12)C)C)C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CC(=CNC2=C(C(=C(N12)C)C)C#N)C(=O)OCC

InChI

InChI=1S/C17H21N3O4/c1-5-23-16(21)12-7-14(17(22)24-6-2)20-11(4)10(3)13(8-18)15(20)19-9-12/h9,14,19H,5-7H2,1-4H3