N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(1-propan-2-ylpyrazol-4-yl)carbonylpiperidin-4-yl]propanamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(1-propan-2-ylpyrazol-4-yl)carbonylpiperidin-4-yl]propanamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(1-isopropylpyrazole-4-carbonyl)-4-piperidyl]propanamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-[1-[oxo-(1-propan-2-yl-4-pyrazolyl)methyl]-4-piperidinyl]propanamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(1-propan-2-ylpyrazole-4-carbonyl)piperidin-4-yl]propanamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(1-isopropylpyrazole-4-carbonyl)-4-piperidyl]propionamide Formula: C22H38N5O2+ MolecularWeight: 404.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)CCC2CCN(CC2)C(=O)C3=CN(N=C3)C(C)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)CCC2CCN(CC2)C(=O)C3=CN(N=C3)C(C)C

InChI

InChI=1S/C22H37N5O2/c1-4-25-11-5-6-20(25)15-23-21(28)8-7-18-9-12-26(13-10-18)22(29)19-14-24-27(16-19)17(2)3/h14,16-18,20H,4-13,15H2,1-3H3,(H,23,28)/p+1/t20-/m0/s1