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

Systemtic Name: 4-[[4-[(4-chlorophenyl)amino]phthalazin-1-yl]oxymethyl]pyridine-2-carboxamide Openeye Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]pyridine-2-carboxamide CAS Name: 4-[[4-(4-chloroanilino)-1-phthalazinyl]oxymethyl]-2-pyridinecarboxamide IUPAC Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]pyridine-2-carboxamide Traditional Name: 4-[[4-(4-chloroanilino)phthalazin-1-yl]oxymethyl]picolinamide Formula: C21H16ClN5O2 MolecularWeight: 405.83704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16ClN5O2/c22-14-5-7-15(8-6-14)25-20-16-3-1-2-4-17(16)21(27-26-20)29-12-13-9-10-24-18(11-13)19(23)28/h1-11H,12H2,(H2,23,28)(H,25,26)