2-[(4-methoxyphenyl)-(thian-4-ylcarbonyl)amino]ethanoic acid

Systemtic Name: 2-[(4-methoxyphenyl)-(thian-4-ylcarbonyl)amino]ethanoic acid Openeye Name: 2-[4-methoxy-N-(tetrahydrothiopyran-4-carbonyl)anilino]acetic acid CAS Name: 2-(4-methoxy-N-[oxo(4-thianyl)methyl]anilino)acetic acid IUPAC Name: 2-[4-methoxy-N-(thiane-4-carbonyl)anilino]acetic acid Traditional Name: 2-[4-methoxy-N-(tetrahydrothiopyran-4-carbonyl)anilino]acetic acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2CCSCC2

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2CCSCC2

InChI

InChI=1S/C15H19NO4S/c1-20-13-4-2-12(3-5-13)16(10-14(17)18)15(19)11-6-8-21-9-7-11/h2-5,11H,6-10H2,1H3,(H,17,18)