1-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[[2-[2-(dimethylamino)-2-oxo-ethyl]thiazol-4-yl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[[2-[2-(dimethylamino)-2-oxoethyl]-4-thiazolyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[[2-[2-(dimethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[[2-[2-(dimethylamino)-2-keto-ethyl]thiazol-4-yl]methyl]nipecotic acid Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC1=NC(=CS1)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CN(C)C(=O)CC1=NC(=CS1)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C14H21N3O3S/c1-16(2)13(18)6-12-15-11(9-21-12)8-17-5-3-4-10(7-17)14(19)20/h9-10H,3-8H2,1-2H3,(H,19,20)