5-methyl-2-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,3-oxazole

Systemtic Name: 5-methyl-2-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,3-oxazole Openeye Name: 5-methyl-2-(m-tolyl)-4-(piperidin-1-ium-1-ylmethyl)oxazole CAS Name: 5-methyl-2-(3-methylphenyl)-4-(1-piperidin-1-iumylmethyl)oxazole IUPAC Name: 5-methyl-2-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,3-oxazole Traditional Name: 5-methyl-2-(m-tolyl)-4-(piperidin-1-ium-1-ylmethyl)oxazole Formula: C17H23N2O+ MolecularWeight: 271.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCCC3

InChI

InChI=1S/C17H22N2O/c1-13-7-6-8-15(11-13)17-18-16(14(2)20-17)12-19-9-4-3-5-10-19/h6-8,11H,3-5,9-10,12H2,1-2H3/p+1