5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(3-pyridinylmethoxy)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-methyl-2-(4-phenylphenyl)-4-[[(3S)-3-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole Formula: C28H30N3O2+ MolecularWeight: 440.5567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3)C[NH+]4CCCC(C4)OCC5=CN=CC=C5

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3)C[NH+]4CCC[C@@H](C4)OCC5=CN=CC=C5

InChI

InChI=1S/C28H29N3O2/c1-21-27(19-31-16-6-10-26(18-31)32-20-22-7-5-15-29-17-22)30-28(33-21)25-13-11-24(12-14-25)23-8-3-2-4-9-23/h2-5,7-9,11-15,17,26H,6,10,16,18-20H2,1H3/p+1/t26-/m0/s1