methyl 1-[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-oxo-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C[NH+]2CCC(CC2)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CS1)NC(=O)C[NH+]2CCC(CC2)C(=O)OC

InChI

InChI=1S/C15H22N2O3S/c1-11(13-4-3-9-21-13)16-14(18)10-17-7-5-12(6-8-17)15(19)20-2/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,16,18)/p+1/t11-/m1/s1