[(3S)-1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone

Systemtic Name: [(3S)-1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone Openeye Name: [(3S)-1-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone CAS Name: [(3S)-1-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methyl]-3-piperidin-1-iumyl]-phenylmethanone IUPAC Name: [(3S)-1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenylmethanone Traditional Name: [(3S)-1-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone Formula: C24H27N2O2+ MolecularWeight: 375.48338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)C)C[NH+]3CCCC(C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)C)C[NH+]3CCC[C@@H](C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O2/c1-17-10-12-20(13-11-17)24-25-22(18(2)28-24)16-26-14-6-9-21(15-26)23(27)19-7-4-3-5-8-19/h3-5,7-8,10-13,21H,6,9,14-16H2,1-2H3/p+1/t21-/m0/s1