N-(4-butylphenyl)-3-(4-chlorophenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-4-keto-phthalazine-1-carboxamide Formula: C25H22ClN3O2 MolecularWeight: 431.91408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3O2/c1-2-3-6-17-9-13-19(14-10-17)27-24(30)23-21-7-4-5-8-22(21)25(31)29(28-23)20-15-11-18(26)12-16-20/h4-5,7-16H,2-3,6H2,1H3,(H,27,30)