1-(4-cyclopentylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butan-1-one

Systemtic Name: 1-(4-cyclopentylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butan-1-one Openeye Name: 1-(4-cyclopentylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butan-1-one CAS Name: 1-(4-cyclopentylphenyl)-4-(4-methyl-1-piperazin-4-iumyl)-1-butanone IUPAC Name: 1-(4-cyclopentylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butan-1-one Traditional Name: 1-(4-cyclopentylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butan-1-one Formula: C20H31N2O+ MolecularWeight: 315.47294

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)C3CCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)C3CCCC3

InChI

InChI=1S/C20H30N2O/c1-21-13-15-22(16-14-21)12-4-7-20(23)19-10-8-18(9-11-19)17-5-2-3-6-17/h8-11,17H,2-7,12-16H2,1H3/p+1