(2R)-2-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]-3-methylsulfanyl-propanoate

Systemtic Name: (2R)-2-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]-3-methylsulfanyl-propanoate Openeye Name: (2R)-2-[[2-(3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-methylsulfanyl-propanoate CAS Name: (2R)-2-[[2-[[4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-3-(methylthio)propanoate IUPAC Name: (2R)-2-[[2-(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-methylsulfanylpropanoate Traditional Name: (2R)-2-[[2-(3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl)oxyacetyl]amino]-3-(methylthio)propionate Formula: C24H24NO6S- MolecularWeight: 454.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(CSC)C(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@@H](CSC)C(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C24H25NO6S/c1-14-17-9-10-20(30-12-21(26)25-19(13-32-3)23(27)28)15(2)22(17)31-24(29)18(14)11-16-7-5-4-6-8-16/h4-10,19H,11-13H2,1-3H3,(H,25,26)(H,27,28)/p-1/t19-/m0/s1