phenyl 4-(4-acetamidophenyl)-6-chloranyl-1-methyl-1H-phthalazine-2-carboxylate

Systemtic Name: phenyl 4-(4-acetamidophenyl)-6-chloranyl-1-methyl-1H-phthalazine-2-carboxylate Openeye Name: phenyl 4-(4-acetamidophenyl)-6-chloro-1-methyl-1H-phthalazine-2-carboxylate CAS Name: 4-(4-acetamidophenyl)-6-chloro-1-methyl-1H-phthalazine-2-carboxylic acid phenyl ester IUPAC Name: phenyl 4-(4-acetamidophenyl)-6-chloro-1-methyl-1H-phthalazine-2-carboxylate Traditional Name: 4-(4-acetamidophenyl)-6-chloro-1-methyl-1H-phthalazine-2-carboxylic acid phenyl ester Formula: C24H20ClN3O3 MolecularWeight: 433.8869

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=C(C=C2)Cl)C(=NN1C(=O)OC3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1C2=C(C=C(C=C2)Cl)C(=NN1C(=O)OC3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C24H20ClN3O3/c1-15-21-13-10-18(25)14-22(21)23(17-8-11-19(12-9-17)26-16(2)29)27-28(15)24(30)31-20-6-4-3-5-7-20/h3-15H,1-2H3,(H,26,29)