ethyl 6-(butan-2-ylamino)-4-oxidanylidene-1H-cinnoline-3-carboxylate

Systemtic Name: ethyl 6-(butan-2-ylamino)-4-oxidanylidene-1H-cinnoline-3-carboxylate Openeye Name: ethyl 4-oxo-6-(sec-butylamino)-1H-cinnoline-3-carboxylate CAS Name: 6-(butan-2-ylamino)-4-oxo-1H-cinnoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(butan-2-ylamino)-4-oxo-1H-cinnoline-3-carboxylate Traditional Name: 4-keto-6-(sec-butylamino)-1H-cinnoline-3-carboxylic acid ethyl ester Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=CC2=C(C=C1)NN=C(C2=O)C(=O)OCC

Isomeric SMILES

CCC(C)NC1=CC2=C(C=C1)NN=C(C2=O)C(=O)OCC

InChI

InChI=1S/C15H19N3O3/c1-4-9(3)16-10-6-7-12-11(8-10)14(19)13(18-17-12)15(20)21-5-2/h6-9,16H,4-5H2,1-3H3,(H,17,19)