(2R)-3-methylsulfanyl-2-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoylamino]propanoate

Systemtic Name: (2R)-3-methylsulfanyl-2-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoylamino]propanoate Openeye Name: (2R)-3-methylsulfanyl-2-[[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]propanoate CAS Name: (2R)-3-(methylthio)-2-[[1-oxo-2-[(6-oxo-3-benzo[c][1]benzopyranyl)oxy]ethyl]amino]propanoate IUPAC Name: (2R)-3-methylsulfanyl-2-[[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]propanoate Traditional Name: (2R)-2-[[2-(6-ketobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-(methylthio)propionate Formula: C19H16NO6S- MolecularWeight: 386.39844

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CSC[C@@H](C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C19H17NO6S/c1-27-10-15(18(22)23)20-17(21)9-25-11-6-7-13-12-4-2-3-5-14(12)19(24)26-16(13)8-11/h2-8,15H,9-10H2,1H3,(H,20,21)(H,22,23)/p-1/t15-/m0/s1