1-(4-ethylpiperazin-4-ium-1-yl)-3-[1-(6-methylpyridin-3-yl)carbonylpiperidin-4-yl]propan-1-one

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[1-(6-methylpyridin-3-yl)carbonylpiperidin-4-yl]propan-1-one Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[1-(6-methylpyridine-3-carbonyl)-4-piperidyl]propan-1-one CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-3-[1-[(6-methyl-3-pyridinyl)-oxomethyl]-4-piperidinyl]-1-propanone IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]propan-1-one Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[1-(6-methylnicotinoyl)-4-piperidyl]propan-1-one Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=CN=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=CN=C(C=C3)C

InChI

InChI=1S/C21H32N4O2/c1-3-23-12-14-24(15-13-23)20(26)7-5-18-8-10-25(11-9-18)21(27)19-6-4-17(2)22-16-19/h4,6,16,18H,3,5,7-15H2,1-2H3/p+1