(3S,4R)-4-(butylcarbamoyl)thiolane-3-carboxylic acid

Systemtic Name: (3S,4R)-4-(butylcarbamoyl)thiolane-3-carboxylic acid Openeye Name: (3S,4R)-4-(butylcarbamoyl)tetrahydrothiophene-3-carboxylic acid CAS Name: (3S,4R)-4-[butylamino(oxo)methyl]-3-thiolanecarboxylic acid IUPAC Name: (3S,4R)-4-(butylcarbamoyl)thiolane-3-carboxylic acid Traditional Name: (3S,4R)-4-(butylcarbamoyl)tetrahydrothiophene-3-carboxylic acid Formula: C10H17NO3S MolecularWeight: 231.31188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CSCC1C(=O)O

Isomeric SMILES

CCCCNC(=O)[C@@H]1CSC[C@@H]1C(=O)O

InChI

InChI=1S/C10H17NO3S/c1-2-3-4-11-9(12)7-5-15-6-8(7)10(13)14/h7-8H,2-6H2,1H3,(H,11,12)(H,13,14)/t7-,8+/m1/s1