4-[4-[4-(4-ethylpiperazin-1-ium-1-yl)butoxy]phenyl]butan-2-one

Systemtic Name: 4-[4-[4-(4-ethylpiperazin-1-ium-1-yl)butoxy]phenyl]butan-2-one Openeye Name: 4-[4-[4-(4-ethylpiperazin-1-ium-1-yl)butoxy]phenyl]butan-2-one CAS Name: 4-[4-[4-(4-ethyl-1-piperazin-1-iumyl)butoxy]phenyl]-2-butanone IUPAC Name: 4-[4-[4-(4-ethylpiperazin-1-ium-1-yl)butoxy]phenyl]butan-2-one Traditional Name: 4-[4-[4-(4-ethylpiperazin-1-ium-1-yl)butoxy]phenyl]butan-2-one Formula: C20H33N2O2+ MolecularWeight: 333.48822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)CCC(=O)C

Isomeric SMILES

CCN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)CCC(=O)C

InChI

InChI=1S/C20H32N2O2/c1-3-21-13-15-22(16-14-21)12-4-5-17-24-20-10-8-19(9-11-20)7-6-18(2)23/h8-11H,3-7,12-17H2,1-2H3/p+1