2-methoxy-1-[4-[4-[(2S)-4-methyl-2-propan-2-yl-piperazin-4-ium-1-yl]carbonylphenoxy]piperidin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[4-[4-[(2S)-4-methyl-2-propan-2-yl-piperazin-4-ium-1-yl]carbonylphenoxy]piperidin-1-yl]ethanone Openeye Name: 1-[4-[4-[(2S)-2-isopropyl-4-methyl-piperazin-4-ium-1-carbonyl]phenoxy]-1-piperidyl]-2-methoxy-ethanone CAS Name: 2-methoxy-1-[4-[4-[[(2S)-4-methyl-2-propan-2-yl-1-piperazin-4-iumyl]-oxomethyl]phenoxy]-1-piperidinyl]ethanone IUPAC Name: 2-methoxy-1-[4-[4-[(2S)-4-methyl-2-propan-2-ylpiperazin-4-ium-1-carbonyl]phenoxy]piperidin-1-yl]ethanone Traditional Name: 1-[4-[4-[(2S)-2-isopropyl-4-methyl-piperazin-4-ium-1-carbonyl]phenoxy]piperidino]-2-methoxy-ethanone Formula: C23H36N3O4+ MolecularWeight: 418.54964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C[NH+](CCN1C(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)COC)C

Isomeric SMILES

CC(C)[C@H]1C[NH+](CCN1C(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)COC)C

InChI

InChI=1S/C23H35N3O4/c1-17(2)21-15-24(3)13-14-26(21)23(28)18-5-7-19(8-6-18)30-20-9-11-25(12-10-20)22(27)16-29-4/h5-8,17,20-21H,9-16H2,1-4H3/p+1/t21-/m1/s1