methyl 4-[4-[(3-hydroxyphenyl)amino]phthalazin-1-yl]benzoate

Systemtic Name: methyl 4-[4-[(3-hydroxyphenyl)amino]phthalazin-1-yl]benzoate Openeye Name: methyl 4-[4-(3-hydroxyanilino)phthalazin-1-yl]benzoate CAS Name: 4-[4-(3-hydroxyanilino)-1-phthalazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(3-hydroxyanilino)phthalazin-1-yl]benzoate Traditional Name: 4-[4-(3-hydroxyanilino)phthalazin-1-yl]benzoic acid methyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N3O3/c1-28-22(27)15-11-9-14(10-12-15)20-18-7-2-3-8-19(18)21(25-24-20)23-16-5-4-6-17(26)13-16/h2-13,26H,1H3,(H,23,25)