ethyl 2-[(2R)-1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2R)-1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-2-yl]ethanoate Openeye Name: ethyl 2-[(2R)-1-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-2-yl]acetate CAS Name: 2-[(2R)-1-[[5-methyl-2-(3-thiophenyl)-4-oxazolyl]methyl]-2-piperidin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2R)-1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-2-yl]acetate Traditional Name: 2-[(2R)-1-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-2-yl]acetic acid ethyl ester Formula: C18H25N2O3S+ MolecularWeight: 349.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCC[NH+]1CC2=C(OC(=N2)C3=CSC=C3)C

Isomeric SMILES

CCOC(=O)C[C@H]1CCCC[NH+]1CC2=C(OC(=N2)C3=CSC=C3)C

InChI

InChI=1S/C18H24N2O3S/c1-3-22-17(21)10-15-6-4-5-8-20(15)11-16-13(2)23-18(19-16)14-7-9-24-12-14/h7,9,12,15H,3-6,8,10-11H2,1-2H3/p+1/t15-/m1/s1