2-(3-methylphenoxy)-1-[4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-(3-methylphenoxy)-1-[4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl]ethanone Openeye Name: 2-(3-methylphenoxy)-1-[4-[4-(p-tolyl)phthalazin-1-yl]piperazin-1-yl]ethanone CAS Name: 2-(3-methylphenoxy)-1-[4-[4-(4-methylphenyl)-1-phthalazinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-methylphenoxy)-1-[4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl]ethanone Traditional Name: 2-(3-methylphenoxy)-1-[4-[4-(p-tolyl)phthalazin-1-yl]piperazino]ethanone Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C(=O)COC5=CC=CC(=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C(=O)COC5=CC=CC(=C5)C

InChI

InChI=1S/C28H28N4O2/c1-20-10-12-22(13-11-20)27-24-8-3-4-9-25(24)28(30-29-27)32-16-14-31(15-17-32)26(33)19-34-23-7-5-6-21(2)18-23/h3-13,18H,14-17,19H2,1-2H3