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

Systemtic Name: methyl 4-[[4-(4-methylphenyl)phthalazin-1-yl]amino]benzoate Openeye Name: methyl 4-[[4-(p-tolyl)phthalazin-1-yl]amino]benzoate CAS Name: 4-[[4-(4-methylphenyl)-1-phthalazinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-methylphenyl)phthalazin-1-yl]amino]benzoate Traditional Name: 4-[[4-(p-tolyl)phthalazin-1-yl]amino]benzoic acid methyl ester Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H19N3O2/c1-15-7-9-16(10-8-15)21-19-5-3-4-6-20(19)22(26-25-21)24-18-13-11-17(12-14-18)23(27)28-2/h3-14H,1-2H3,(H,24,26)