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

Systemtic Name: 4-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)-1,3-oxazole Openeye Name: 4-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole CAS Name: 4-[[(3S)-3-methoxy-1-piperidin-1-iumyl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole IUPAC Name: 4-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)-1,3-oxazole Traditional Name: 4-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole Formula: C23H27N2O2+ MolecularWeight: 363.47268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O2/c1-17-22(16-25-14-6-9-21(15-25)26-2)24-23(27-17)20-12-10-19(11-13-20)18-7-4-3-5-8-18/h3-5,7-8,10-13,21H,6,9,14-16H2,1-2H3/p+1/t21-/m0/s1