5,5-dimethyl-2-(pentanoylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid

Systemtic Name: 5,5-dimethyl-2-(pentanoylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Openeye Name: 5,5-dimethyl-2-(pentanoylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid CAS Name: 5,5-dimethyl-2-(1-oxopentylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid IUPAC Name: 5,5-dimethyl-2-(pentanoylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Traditional Name: 5,5-dimethyl-2-(valerylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C2=C(S1)COC(C2)(C)C)C(=O)O

Isomeric SMILES

CCCCC(=O)NC1=C(C2=C(S1)COC(C2)(C)C)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-4-5-6-11(17)16-13-12(14(18)19)9-7-15(2,3)20-8-10(9)21-13/h4-8H2,1-3H3,(H,16,17)(H,18,19)