1-cyclopentyl-2-[(1R)-1-methyl-1-[2-(1,2-oxazol-3-yl)ethyl]piperidin-1-ium-3-yl]oxy-2-oxidanylidene-1-phenyl-ethanolate

Systemtic Name: 1-cyclopentyl-2-[(1R)-1-methyl-1-[2-(1,2-oxazol-3-yl)ethyl]piperidin-1-ium-3-yl]oxy-2-oxidanylidene-1-phenyl-ethanolate Openeye Name: 1-cyclopentyl-2-[(1R)-1-(2-isoxazol-3-ylethyl)-1-methyl-piperidin-1-ium-3-yl]oxy-2-oxo-1-phenyl-ethanolate CAS Name: 1-cyclopentyl-2-[[(1R)-1-[2-(3-isoxazolyl)ethyl]-1-methyl-3-piperidin-1-iumyl]oxy]-2-oxo-1-phenylethanolate IUPAC Name: 1-cyclopentyl-2-[(1R)-1-methyl-1-[2-(1,2-oxazol-3-yl)ethyl]piperidin-1-ium-3-yl]oxy-2-oxo-1-phenylethanolate Traditional Name: 1-cyclopentyl-2-[(1R)-1-(2-isoxazol-3-ylethyl)-1-methyl-piperidin-1-ium-3-yl]oxy-2-keto-1-phenyl-ethanolate Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)[O-])CCC4=NOC=C4

Isomeric SMILES

C[N@@+]1(CCCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)[O-])CCC4=NOC=C4

InChI

InChI=1S/C24H32N2O4/c1-26(16-13-21-14-17-29-25-21)15-7-12-22(18-26)30-23(27)24(28,20-10-5-6-11-20)19-8-3-2-4-9-19/h2-4,8-9,14,17,20,22H,5-7,10-13,15-16,18H2,1H3/t22?,24?,26-/m1/s1