1-morpholin-4-yl-3-[(3R)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-3-[(3R)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propan-1-one Openeye Name: 3-[(3R)-1-[(4-benzyloxyphenyl)methyl]piperidin-1-ium-3-yl]-1-morpholino-propan-1-one CAS Name: 1-(4-morpholinyl)-3-[(3R)-1-[(4-phenylmethoxyphenyl)methyl]-3-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-morpholin-4-yl-3-[(3R)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propan-1-one Traditional Name: 3-[(3R)-1-(4-benzoxybenzyl)piperidin-1-ium-3-yl]-1-morpholino-propan-1-one Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CCC(=O)N4CCOCC4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CCC(=O)N4CCOCC4

InChI

InChI=1S/C26H34N2O3/c29-26(28-15-17-30-18-16-28)13-10-22-7-4-14-27(19-22)20-23-8-11-25(12-9-23)31-21-24-5-2-1-3-6-24/h1-3,5-6,8-9,11-12,22H,4,7,10,13-21H2/p+1/t22-/m1/s1