1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)proline Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C14H17NO3S/c16-13(15-7-3-5-10(15)14(17)18)12-8-9-4-1-2-6-11(9)19-12/h8,10H,1-7H2,(H,17,18)