1-[3-methoxy-4-[4-(4-methylpiperazin-1-ium-1-yl)butoxy]phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-[4-(4-methylpiperazin-1-ium-1-yl)butoxy]phenyl]ethanone Openeye Name: 1-[3-methoxy-4-[4-(4-methylpiperazin-1-ium-1-yl)butoxy]phenyl]ethanone CAS Name: 1-[3-methoxy-4-[4-(4-methyl-1-piperazin-1-iumyl)butoxy]phenyl]ethanone IUPAC Name: 1-[3-methoxy-4-[4-(4-methylpiperazin-1-ium-1-yl)butoxy]phenyl]ethanone Traditional Name: 1-[3-methoxy-4-[4-(4-methylpiperazin-1-ium-1-yl)butoxy]phenyl]ethanone Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCCC[NH+]2CCN(CC2)C)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCCC[NH+]2CCN(CC2)C)OC

InChI

InChI=1S/C18H28N2O3/c1-15(21)16-6-7-17(18(14-16)22-3)23-13-5-4-8-20-11-9-19(2)10-12-20/h6-7,14H,4-5,8-13H2,1-3H3/p+1