2-[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[2-(4,7-dimethyl-2-oxo-chromen-5-yl)oxyacetyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[2-[(4,7-dimethyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[2-(4,7-dimethyl-2-oxochromen-5-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[2-(2-keto-4,7-dimethyl-chromen-5-yl)oxyacetyl]amino]-3-(methylthio)propionic acid Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CSC)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CSC)C(=O)O

InChI

InChI=1S/C17H19NO6S/c1-9-4-12(16-10(2)6-15(20)24-13(16)5-9)23-7-14(19)18-11(8-25-3)17(21)22/h4-6,11H,7-8H2,1-3H3,(H,18,19)(H,21,22)