N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H21ClN4O2/c22-14-8-9-19(26-10-4-1-5-11-26)18(12-14)23-20(27)13-17-15-6-2-3-7-16(15)21(28)25-24-17/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,23,27)(H,25,28)