N-[[3-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-N-methyl-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: N-[[3-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-N-methyl-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-[[3-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-N-methyl-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: N-[[3-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl]-N-methyl-3-[(3S)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-[[3-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-N-methyl-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)benzyl]-N-methyl-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C22H33N4O+ MolecularWeight: 369.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)N(C)CC2=CC(=CC=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCC(=O)N(C)CC2=CC(=CC=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C22H32N4O/c1-17-7-6-11-25(15-17)12-10-22(27)24(4)16-20-8-5-9-21(14-20)26-19(3)13-18(2)23-26/h5,8-9,13-14,17H,6-7,10-12,15-16H2,1-4H3/p+1/t17-/m0/s1