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

Systemtic Name: 4-methylsulfanyl-2-[2-[(4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]ethanoylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]butanoic acid CAS Name: 4-(methylthio)-2-[[1-oxo-2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl)oxy]ethyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]butanoic acid Traditional Name: 2-[[2-[(4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]-4-(methylthio)butyric acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO6S/c1-27-8-7-15(18(22)23)20-17(21)10-25-11-5-6-13-12-3-2-4-14(12)19(24)26-16(13)9-11/h5-6,9,15H,2-4,7-8,10H2,1H3,(H,20,21)(H,22,23)