2-chloranyl-N-[5-(4-methoxyphthalazin-1-yl)-2-piperidin-1-yl-phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[5-(4-methoxyphthalazin-1-yl)-2-piperidin-1-yl-phenyl]benzamide Openeye Name: 2-chloro-N-[5-(4-methoxyphthalazin-1-yl)-2-(1-piperidyl)phenyl]benzamide CAS Name: 2-chloro-N-[5-(4-methoxy-1-phthalazinyl)-2-(1-piperidinyl)phenyl]benzamide IUPAC Name: 2-chloro-N-[5-(4-methoxyphthalazin-1-yl)-2-piperidin-1-ylphenyl]benzamide Traditional Name: 2-chloro-N-[5-(4-methoxyphthalazin-1-yl)-2-piperidino-phenyl]benzamide Formula: C27H25ClN4O2 MolecularWeight: 472.966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)N4CCCCC4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

COC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)N4CCCCC4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H25ClN4O2/c1-34-27-20-10-4-3-9-19(20)25(30-31-27)18-13-14-24(32-15-7-2-8-16-32)23(17-18)29-26(33)21-11-5-6-12-22(21)28/h3-6,9-14,17H,2,7-8,15-16H2,1H3,(H,29,33)