ethyl 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-oxidanylidene-quinolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-oxidanylidene-quinolizine-1-carboxylate Openeye Name: ethyl 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-oxo-quinolizine-1-carboxylate CAS Name: 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-oxo-1-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-oxoquinolizine-1-carboxylate Traditional Name: 3-cyano-2-(1H-imidazol-5-ylmethylamino)-4-keto-quinolizine-1-carboxylic acid ethyl ester Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1NCC3=CN=CN3)C#N

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1NCC3=CN=CN3)C#N

InChI

InChI=1S/C17H15N5O3/c1-2-25-17(24)14-13-5-3-4-6-22(13)16(23)12(7-18)15(14)20-9-11-8-19-10-21-11/h3-6,8,10,20H,2,9H2,1H3,(H,19,21)