1-(4-chlorophenyl)-N-[[(3R)-1-(phenylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(phenylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide Openeye Name: N-[[(3R)-1-benzylpiperidin-1-ium-3-yl]methyl]-1-(4-chlorophenyl)cyclopropanecarboxamide CAS Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(phenylmethyl)-3-piperidin-1-iumyl]methyl]-1-cyclopropanecarboxamide IUPAC Name: N-[[(3R)-1-benzylpiperidin-1-ium-3-yl]methyl]-1-(4-chlorophenyl)cyclopropane-1-carboxamide Traditional Name: N-[[(3R)-1-benzylpiperidin-1-ium-3-yl]methyl]-1-(4-chlorophenyl)cyclopropanecarboxamide Formula: C23H28ClN2O+ MolecularWeight: 383.93422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H27ClN2O/c24-21-10-8-20(9-11-21)23(12-13-23)22(27)25-15-19-7-4-14-26(17-19)16-18-5-2-1-3-6-18/h1-3,5-6,8-11,19H,4,7,12-17H2,(H,25,27)/p+1/t19-/m1/s1