(3R)-N-[4-(3-methoxyphenyl)phenyl]-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-N-[4-(3-methoxyphenyl)phenyl]-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(3-isopropyl-1H-pyrazol-5-yl)methyl]-N-[4-(3-methoxyphenyl)phenyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-N-[4-(3-methoxyphenyl)phenyl]-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-N-[4-(3-methoxyphenyl)phenyl]-1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(3-isopropyl-1H-pyrazol-5-yl)methyl]-N-[4-(3-methoxyphenyl)phenyl]piperidin-1-ium-3-carboxamide Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=C1)C[NH+]2CCCC(C2)C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)C1=NNC(=C1)C[NH+]2CCC[C@H](C2)C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H32N4O2/c1-18(2)25-15-23(28-29-25)17-30-13-5-7-21(16-30)26(31)27-22-11-9-19(10-12-22)20-6-4-8-24(14-20)32-3/h4,6,8-12,14-15,18,21H,5,7,13,16-17H2,1-3H3,(H,27,31)(H,28,29)/p+1/t21-/m1/s1