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

Systemtic Name: 4-methoxy-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-methoxy-1-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)proline Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC3=C(S2)CCCC3)C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)C2=CC3=C(S2)CCCC3)C(=O)O

InChI

InChI=1S/C15H19NO4S/c1-20-10-7-11(15(18)19)16(8-10)14(17)13-6-9-4-2-3-5-12(9)21-13/h6,10-11H,2-5,7-8H2,1H3,(H,18,19)