ethyl 5-azanyl-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: ethyl 5-azanyl-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: ethyl 5-amino-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-oxo-phthalazine-1-carboxylate CAS Name: 5-amino-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-oxo-1-phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-oxophthalazine-1-carboxylate Traditional Name: 5-amino-3-(3-chlorophenyl)-7-(4-chlorophenyl)-6-cyano-4-keto-phthalazine-1-carboxylic acid ethyl ester Formula: C24H16Cl2N4O3 MolecularWeight: 479.31484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H16Cl2N4O3/c1-2-33-24(32)22-18-11-17(13-6-8-14(25)9-7-13)19(12-27)21(28)20(18)23(31)30(29-22)16-5-3-4-15(26)10-16/h3-11H,2,28H2,1H3