4-methylsulfanyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]butanoic acid Openeye Name: 2-[(7-hydroxy-2-oxo-chromen-8-yl)methylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(7-hydroxy-2-oxo-1-benzopyran-8-yl)methylamino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(7-hydroxy-2-oxochromen-8-yl)methylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(7-hydroxy-2-keto-chromen-8-yl)methylamino]-4-(methylthio)butyric acid Formula: C15H17NO5S MolecularWeight: 323.36418

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NCC1=C(C=CC2=C1OC(=O)C=C2)O

Isomeric SMILES

CSCCC(C(=O)O)NCC1=C(C=CC2=C1OC(=O)C=C2)O

InChI

InChI=1S/C15H17NO5S/c1-22-7-6-11(15(19)20)16-8-10-12(17)4-2-9-3-5-13(18)21-14(9)10/h2-5,11,16-17H,6-8H2,1H3,(H,19,20)