methyl 4-[4-[[4-(dimethylcarbamoyl)phenyl]amino]phthalazin-1-yl]benzoate

Systemtic Name: methyl 4-[4-[[4-(dimethylcarbamoyl)phenyl]amino]phthalazin-1-yl]benzoate Openeye Name: methyl 4-[4-[4-(dimethylcarbamoyl)anilino]phthalazin-1-yl]benzoate CAS Name: 4-[4-[4-[dimethylamino(oxo)methyl]anilino]-1-phthalazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[4-(dimethylcarbamoyl)anilino]phthalazin-1-yl]benzoate Traditional Name: 4-[4-[4-(dimethylcarbamoyl)anilino]phthalazin-1-yl]benzoic acid methyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H22N4O3/c1-29(2)24(30)17-12-14-19(15-13-17)26-23-21-7-5-4-6-20(21)22(27-28-23)16-8-10-18(11-9-16)25(31)32-3/h4-15H,1-3H3,(H,26,28)