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

Systemtic Name: N-[5-(4-methoxyphthalazin-1-yl)-2-piperidin-1-yl-phenyl]benzamide Openeye Name: N-[5-(4-methoxyphthalazin-1-yl)-2-(1-piperidyl)phenyl]benzamide CAS Name: N-[5-(4-methoxy-1-phthalazinyl)-2-(1-piperidinyl)phenyl]benzamide IUPAC Name: N-[5-(4-methoxyphthalazin-1-yl)-2-piperidin-1-ylphenyl]benzamide Traditional Name: N-[5-(4-methoxyphthalazin-1-yl)-2-piperidino-phenyl]benzamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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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=C5

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O2/c1-33-27-22-13-7-6-12-21(22)25(29-30-27)20-14-15-24(31-16-8-3-9-17-31)23(18-20)28-26(32)19-10-4-2-5-11-19/h2,4-7,10-15,18H,3,8-9,16-17H2,1H3,(H,28,32)