N-(5-chloranyl-2-methoxy-phenyl)-3-[(3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[(3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[(3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[(3R)-1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[(3R)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[(3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propionamide Formula: C22H32ClN4O2+ MolecularWeight: 419.96808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+]2CCCC(C2)CCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+]2CCC[C@@H](C2)CCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C22H31ClN4O2/c1-4-27-15-18(16(2)25-27)14-26-11-5-6-17(13-26)7-10-22(28)24-20-12-19(23)8-9-21(20)29-3/h8-9,12,15,17H,4-7,10-11,13-14H2,1-3H3,(H,24,28)/p+1/t17-/m1/s1