2-[2-methoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-methoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]ethanenitrile Openeye Name: 2-[2-methoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]acetonitrile CAS Name: 2-[2-methoxy-4-[(Z)-(4-methyl-1-piperazin-4-iumyl)iminomethyl]phenoxy]acetonitrile IUPAC Name: 2-[2-methoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]acetonitrile Traditional Name: 2-[2-methoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]acetonitrile Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C=C2)OCC#N)OC

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C=C2)OCC#N)OC

InChI

InChI=1S/C15H20N4O2/c1-18-6-8-19(9-7-18)17-12-13-3-4-14(21-10-5-16)15(11-13)20-2/h3-4,11-12H,6-10H2,1-2H3/p+1/b17-12-