[(3S)-1-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-pyridin-3-yl-methanone

Systemtic Name: [(3S)-1-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-pyridin-3-yl-methanone Openeye Name: [(3S)-1-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-(3-pyridyl)methanone CAS Name: [(3S)-1-[[2-(2-ethoxyphenyl)-5-methyl-4-oxazolyl]methyl]-3-piperidin-1-iumyl]-(3-pyridinyl)methanone IUPAC Name: [(3S)-1-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-pyridin-3-ylmethanone Traditional Name: [(3S)-1-[(5-methyl-2-o-phenetyl-oxazol-4-yl)methyl]piperidin-1-ium-3-yl]-(3-pyridyl)methanone Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+]3CCCC(C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+]3CCC[C@@H](C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H27N3O3/c1-3-29-22-11-5-4-10-20(22)24-26-21(17(2)30-24)16-27-13-7-9-19(15-27)23(28)18-8-6-12-25-14-18/h4-6,8,10-12,14,19H,3,7,9,13,15-16H2,1-2H3/p+1/t19-/m0/s1