2-[4-(4-phenylazanylphthalazin-1-yl)phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(4-phenylazanylphthalazin-1-yl)phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(4-anilinophthalazin-1-yl)phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[4-(4-anilino-1-phthalazinyl)phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(4-anilinophthalazin-1-yl)phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(4-anilinophthalazin-1-yl)phenoxy]-1-piperidino-ethanone Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=NN=C(C4=CC=CC=C43)NC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=NN=C(C4=CC=CC=C43)NC5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2/c32-25(31-17-7-2-8-18-31)19-33-22-15-13-20(14-16-22)26-23-11-5-6-12-24(23)27(30-29-26)28-21-9-3-1-4-10-21/h1,3-6,9-16H,2,7-8,17-19H2,(H,28,30)