3-methylsulfanyl-2-[2-[(4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]ethanoylamino]propanoic acid

Systemtic Name: 3-methylsulfanyl-2-[2-[(4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]ethanoylamino]propanoic acid Openeye Name: 3-methylsulfanyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid CAS Name: 3-(methylthio)-2-[[1-oxo-2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl)oxy]ethyl]amino]propanoic acid IUPAC Name: 3-methylsulfanyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid Traditional Name: 2-[[2-[(4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]-3-(methylthio)propionic acid Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2

Isomeric SMILES

CSCC(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2

InChI

InChI=1S/C18H19NO6S/c1-26-9-14(17(21)22)19-16(20)8-24-10-5-6-12-11-3-2-4-13(11)18(23)25-15(12)7-10/h5-7,14H,2-4,8-9H2,1H3,(H,19,20)(H,21,22)