ethyl 5-azanyl-4-oxidanylidene-3,7-diphenyl-pyrido[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 5-azanyl-4-oxidanylidene-3,7-diphenyl-pyrido[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 5-amino-4-oxo-3,7-diphenyl-pyrido[3,4-d]pyridazine-1-carboxylate CAS Name: 5-amino-4-oxo-3,7-diphenyl-1-pyrido[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-oxo-3,7-diphenylpyrido[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-amino-4-keto-3,7-diphenyl-pyrido[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(N=C(C=C21)C3=CC=CC=C3)N)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(N=C(C=C21)C3=CC=CC=C3)N)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-2-29-22(28)19-16-13-17(14-9-5-3-6-10-14)24-20(23)18(16)21(27)26(25-19)15-11-7-4-8-12-15/h3-13H,2H2,1H3,(H2,23,24)