ethyl 6-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]-4-oxidanylidene-1H-cinnoline-3-carboxylate

Systemtic Name: ethyl 6-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]-4-oxidanylidene-1H-cinnoline-3-carboxylate Openeye Name: ethyl 6-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]-4-oxo-1H-cinnoline-3-carboxylate CAS Name: 6-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]-4-oxo-1H-cinnoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4-oxo-1H-cinnoline-3-carboxylate Traditional Name: 4-keto-6-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]-1H-cinnoline-3-carboxylic acid ethyl ester Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC2=C(C1=O)C=C(C=C2)NC3=CC(=O)CC(C3)(C)C

Isomeric SMILES

CCOC(=O)C1=NNC2=C(C1=O)C=C(C=C2)NC3=CC(=O)CC(C3)(C)C

InChI

InChI=1S/C19H21N3O4/c1-4-26-18(25)16-17(24)14-8-11(5-6-15(14)21-22-16)20-12-7-13(23)10-19(2,3)9-12/h5-8,20H,4,9-10H2,1-3H3,(H,21,24)