(2R,3R)-1-(2-methoxyethyl)-2-(3-methylthiophen-2-yl)-6-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: (2R,3R)-1-(2-methoxyethyl)-2-(3-methylthiophen-2-yl)-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: (2R,3R)-1-(2-methoxyethyl)-2-(3-methyl-2-thienyl)-6-oxo-piperidine-3-carboxylic acid CAS Name: (2R,3R)-1-(2-methoxyethyl)-2-(3-methyl-2-thiophenyl)-6-oxo-3-piperidinecarboxylic acid IUPAC Name: (2R,3R)-1-(2-methoxyethyl)-2-(3-methylthiophen-2-yl)-6-oxopiperidine-3-carboxylic acid Traditional Name: (2R,3R)-6-keto-1-(2-methoxyethyl)-2-(3-methyl-2-thienyl)nipecotic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(CCC(=O)N2CCOC)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)[C@H]2[C@@H](CCC(=O)N2CCOC)C(=O)O

InChI

InChI=1S/C14H19NO4S/c1-9-5-8-20-13(9)12-10(14(17)18)3-4-11(16)15(12)6-7-19-2/h5,8,10,12H,3-4,6-7H2,1-2H3,(H,17,18)/t10-,12-/m1/s1