2-[2-ethoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-ethoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-ethoxy-4-[(Z)-(4-methyl-1-piperazin-4-iumyl)iminomethyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-ethoxy-4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenoxy]-1-piperidino-ethanone Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2CC[NH+](CC2)C)OCC(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2CC[NH+](CC2)C)OCC(=O)N3CCCCC3

InChI

InChI=1S/C21H32N4O3/c1-3-27-20-15-18(16-22-25-13-11-23(2)12-14-25)7-8-19(20)28-17-21(26)24-9-5-4-6-10-24/h7-8,15-16H,3-6,9-14,17H2,1-2H3/p+1/b22-16-