6-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-2-phenyl-1,4-dihydropyridazin-3-one

Systemtic Name: 6-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-2-phenyl-1,4-dihydropyridazin-3-one Openeye Name: 6-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one CAS Name: 6-[[4-[2-(4-methylphenoxy)ethyl]-1-piperazin-4-iumyl]-oxomethyl]-2-phenyl-1,4-dihydropyridazin-3-one IUPAC Name: 6-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one Traditional Name: 6-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CCC(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CCC(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-19-7-9-21(10-8-19)31-18-17-26-13-15-27(16-14-26)24(30)22-11-12-23(29)28(25-22)20-5-3-2-4-6-20/h2-11,25H,12-18H2,1H3/p+1