methyl 2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C18H21NO6S/c1-11-8-17(21)25-15-9-12(4-5-13(11)15)24-10-16(20)19-14(6-7-26-3)18(22)23-2/h4-5,8-9,14H,6-7,10H2,1-3H3,(H,19,20)