2-[[1,1-bis(oxidanylidene)thiocan-5-yl]carbonyl-(4-methoxyphenyl)amino]ethanoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)thiocan-5-yl]carbonyl-(4-methoxyphenyl)amino]ethanoic acid Openeye Name: 2-(N-(1,1-dioxothiocane-5-carbonyl)-4-methoxy-anilino)acetic acid CAS Name: 2-(N-[(1,1-dioxo-5-thiocanyl)-oxomethyl]-4-methoxyanilino)acetic acid IUPAC Name: 2-(N-(1,1-dioxothiocane-5-carbonyl)-4-methoxyanilino)acetic acid Traditional Name: 2-(N-(1,1-diketothiocane-5-carbonyl)-4-methoxy-anilino)acetic acid Formula: C17H23NO6S MolecularWeight: 369.43262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2CCCS(=O)(=O)CCC2

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2CCCS(=O)(=O)CCC2

InChI

InChI=1S/C17H23NO6S/c1-24-15-8-6-14(7-9-15)18(12-16(19)20)17(21)13-4-2-10-25(22,23)11-3-5-13/h6-9,13H,2-5,10-12H2,1H3,(H,19,20)