ethoxybenzene; 3-(4-piperazin-1-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: ethoxybenzene; 3-(4-piperazin-1-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one Openeye Name: ethoxybenzene; 3-(4-piperazin-1-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: ethoxybenzene; 3-[4-(1-piperazinyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: ethoxybenzene; 3-(4-piperazin-1-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one Traditional Name: phenetole; 3-(4-piperazinophenyl)-4,5-dihydro-1H-pyridazin-6-one Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1.C1CC(=O)NN=C1C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CCOC1=CC=CC=C1.C1CC(=O)NN=C1C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C14H18N4O.C8H10O/c19-14-6-5-13(16-17-14)11-1-3-12(4-2-11)18-9-7-15-8-10-18;1-2-9-8-6-4-3-5-7-8/h1-4,15H,5-10H2,(H,17,19);3-7H,2H2,1H3