4-[[4-[(4-chlorophenyl)amino]phthalazin-1-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[[4-[(4-chlorophenyl)amino]phthalazin-1-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-(4-chloroanilino)-1-phthalazinyl]oxymethyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]-N-methyl-picolinamide Formula: C22H18ClN5O2 MolecularWeight: 419.86362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)COC2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)COC2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN5O2/c1-24-21(29)19-12-14(10-11-25-19)13-30-22-18-5-3-2-4-17(18)20(27-28-22)26-16-8-6-15(23)7-9-16/h2-12H,13H2,1H3,(H,24,29)(H,26,27)