methyl 1-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[[2-(4-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[2-(4-chlorophenyl)-5-methyl-4-oxazolyl]methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[2-(4-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C18H22ClN2O3+ MolecularWeight: 349.83188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)C[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)C[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C18H21ClN2O3/c1-12-16(11-21-9-7-14(8-10-21)18(22)23-2)20-17(24-12)13-3-5-15(19)6-4-13/h3-6,14H,7-11H2,1-2H3/p+1