2-[2-[(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(2-methoxy-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[2-methoxy-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(2-methoxy-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-keto-2-(2-methoxy-5-morpholinosulfonyl-anilino)ethyl]thio]acetic acid Formula: C15H20N2O7S2 MolecularWeight: 404.4585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCC(=O)O

InChI

InChI=1S/C15H20N2O7S2/c1-23-13-3-2-11(26(21,22)17-4-6-24-7-5-17)8-12(13)16-14(18)9-25-10-15(19)20/h2-3,8H,4-7,9-10H2,1H3,(H,16,18)(H,19,20)