N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-4-yl]methyl]-N-methyl-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-4-yl]methyl]-N-methyl-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[1-[2-(4-chlorophenyl)ethyl]-4-piperidyl]methyl]-N-methyl-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[1-[2-(4-chlorophenyl)ethyl]-4-piperidinyl]methyl]-N-methyl-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-4-yl]methyl]-N-methyl-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[[1-[2-(4-chlorophenyl)ethyl]-4-piperidyl]methyl]-4-keto-N-methyl-3H-phthalazine-1-carboxamide Formula: C24H27ClN4O2 MolecularWeight: 438.94978

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCN(CC1)CCC2=CC=C(C=C2)Cl)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CN(CC1CCN(CC1)CCC2=CC=C(C=C2)Cl)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C24H27ClN4O2/c1-28(24(31)22-20-4-2-3-5-21(20)23(30)27-26-22)16-18-11-14-29(15-12-18)13-10-17-6-8-19(25)9-7-17/h2-9,18H,10-16H2,1H3,(H,27,30)