4-[[(2S)-2-(2-methoxyethyl)piperidin-1-ium-1-yl]methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole

Systemtic Name: 4-[[(2S)-2-(2-methoxyethyl)piperidin-1-ium-1-yl]methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole Openeye Name: 4-[[(2S)-2-(2-methoxyethyl)piperidin-1-ium-1-yl]methyl]-5-methyl-2-(m-tolyl)oxazole CAS Name: 4-[[(2S)-2-(2-methoxyethyl)-1-piperidin-1-iumyl]methyl]-5-methyl-2-(3-methylphenyl)oxazole IUPAC Name: 4-[[(2S)-2-(2-methoxyethyl)piperidin-1-ium-1-yl]methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole Traditional Name: 4-[[(2S)-2-(2-methoxyethyl)piperidin-1-ium-1-yl]methyl]-5-methyl-2-(m-tolyl)oxazole Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCCC3CCOC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCC[C@H]3CCOC

InChI

InChI=1S/C20H28N2O2/c1-15-7-6-8-17(13-15)20-21-19(16(2)24-20)14-22-11-5-4-9-18(22)10-12-23-3/h6-8,13,18H,4-5,9-12,14H2,1-3H3/p+1/t18-/m0/s1