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

Systemtic Name: methyl 1-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[5-methyl-2-(3-phenoxyphenyl)-4-oxazolyl]methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C24H27N2O4+ MolecularWeight: 407.48218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCC(CC4)C(=O)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCC(CC4)C(=O)OC

InChI

InChI=1S/C24H26N2O4/c1-17-22(16-26-13-11-18(12-14-26)24(27)28-2)25-23(29-17)19-7-6-10-21(15-19)30-20-8-4-3-5-9-20/h3-10,15,18H,11-14,16H2,1-2H3/p+1