3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]propan-1-ol

Systemtic Name: 3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]propan-1-ol Openeye Name: 3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)oxazol-4-yl]methyl]piperidin-1-ium-2-yl]propan-1-ol CAS Name: 3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)-4-oxazolyl]methyl]-2-piperidin-1-iumyl]-1-propanol IUPAC Name: 3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]propan-1-ol Traditional Name: 3-[(2S)-1-[[5-methyl-2-(4-phenylphenyl)oxazol-4-yl]methyl]piperidin-1-ium-2-yl]propan-1-ol Formula: C25H31N2O2+ MolecularWeight: 391.52584

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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+]4CCCCC4CCCO

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3)C[NH+]4CCCC[C@H]4CCCO

InChI

InChI=1S/C25H30N2O2/c1-19-24(18-27-16-6-5-10-23(27)11-7-17-28)26-25(29-19)22-14-12-21(13-15-22)20-8-3-2-4-9-20/h2-4,8-9,12-15,23,28H,5-7,10-11,16-18H2,1H3/p+1/t23-/m0/s1