3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile

Systemtic Name: 3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile Openeye Name: 3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile CAS Name: 3-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-5,6-dimethyl-4-pyridazinecarbonitrile IUPAC Name: 3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-5,6-dimethylpyridazine-4-carbonitrile Traditional Name: 3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN=C1C)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=C(C(=NN=C1C)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C20H25N5O2/c1-15-16(2)22-23-20(19(15)14-21)25-10-8-24(9-11-25)12-13-27-18-6-4-17(26-3)5-7-18/h4-7H,8-13H2,1-3H3/p+1