N-[1-[[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]methyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]methyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[[1-oxo-4-(p-tolyl)phthalazin-2-yl]methyl]-4-piperidyl]benzamide CAS Name: N-[1-[[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]methyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[[4-(4-methylphenyl)-1-oxophthalazin-2-yl]methyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[[1-keto-4-(p-tolyl)phthalazin-2-yl]methyl]-4-piperidyl]benzamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC(CC4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC(CC4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2/c1-20-11-13-21(14-12-20)26-24-9-5-6-10-25(24)28(34)32(30-26)19-31-17-15-23(16-18-31)29-27(33)22-7-3-2-4-8-22/h2-14,23H,15-19H2,1H3,(H,29,33)