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

Systemtic Name: [1-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-phenyl-methanone Openeye Name: [1-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-phenyl-methanone CAS Name: [1-[[2-(2,4-dimethylphenyl)-4-oxazolyl]methyl]-4-piperidin-1-iumyl]-phenylmethanone IUPAC Name: [1-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-phenylmethanone Traditional Name: [1-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methyl]piperidin-1-ium-4-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(=CO2)C[NH+]3CCC(CC3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)C[NH+]3CCC(CC3)C(=O)C4=CC=CC=C4)C

InChI

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