1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxidanylidene-butan-2-yl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxidanylidene-butan-2-yl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)propyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxobutan-2-yl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxobutan-2-yl]piperidine-3-carboxylic acid Traditional Name: 1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)propyl]nipecotic acid Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC2=C(C1)C=CS2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCC(C(=O)N1CCC2=C(C1)C=CS2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C17H24N2O3S/c1-2-14(18-7-3-4-13(11-18)17(21)22)16(20)19-8-5-15-12(10-19)6-9-23-15/h6,9,13-14H,2-5,7-8,10-11H2,1H3,(H,21,22)