N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: 3-[(3R)-1-[(3-isopropyl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-yl]-N-[(3-methoxyphenyl)methyl]propanamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: 3-[(3R)-1-[(3-isopropyl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-yl]-N-m-anisyl-propionamide Formula: C23H35N4O2+ MolecularWeight: 399.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=C1)C[NH+]2CCCC(C2)CCC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)C1=NNC(=C1)C[NH+]2CCC[C@@H](C2)CCC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C23H34N4O2/c1-17(2)22-13-20(25-26-22)16-27-11-5-7-18(15-27)9-10-23(28)24-14-19-6-4-8-21(12-19)29-3/h4,6,8,12-13,17-18H,5,7,9-11,14-16H2,1-3H3,(H,24,28)(H,25,26)/p+1/t18-/m1/s1