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

Systemtic Name: 5-methyl-3-phenyl-4-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole Openeye Name: 5-methyl-3-phenyl-4-(piperidin-1-ium-1-ylmethyl)isoxazole CAS Name: 5-methyl-3-phenyl-4-(1-piperidin-1-iumylmethyl)isoxazole IUPAC Name: 5-methyl-3-phenyl-4-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole Traditional Name: 5-methyl-3-phenyl-4-(piperidin-1-ium-1-ylmethyl)isoxazole Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C16H20N2O/c1-13-15(12-18-10-6-3-7-11-18)16(17-19-13)14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-12H2,1H3/p+1