3-[[4-[(4-chlorophenyl)amino]phthalazin-1-yl]oxymethyl]pyridine-2-carboxylic acid

Systemtic Name: 3-[[4-[(4-chlorophenyl)amino]phthalazin-1-yl]oxymethyl]pyridine-2-carboxylic acid Openeye Name: 3-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]pyridine-2-carboxylic acid CAS Name: 3-[[4-(4-chloroanilino)-1-phthalazinyl]oxymethyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]pyridine-2-carboxylic acid Traditional Name: 3-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]picolinic acid Formula: C21H15ClN4O3 MolecularWeight: 406.8218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2OCC3=C(N=CC=C3)C(=O)O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2OCC3=C(N=CC=C3)C(=O)O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O3/c22-14-7-9-15(10-8-14)24-19-16-5-1-2-6-17(16)20(26-25-19)29-12-13-4-3-11-23-18(13)21(27)28/h1-11H,12H2,(H,24,25)(H,27,28)