2-[2-[4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[2-[4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[2-[4-(4-methoxyphenyl)-8-methyl-2-oxo-chromen-7-yl]oxyacetyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[2-[[4-(4-methoxyphenyl)-8-methyl-2-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[2-[4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl]oxyacetyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[2-[2-keto-4-(4-methoxyphenyl)-8-methyl-chromen-7-yl]oxyacetyl]amino]-3-(methylthio)propionic acid Formula: C23H23NO7S MolecularWeight: 457.49622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OCC(=O)NC(CSC)C(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OCC(=O)NC(CSC)C(=O)O

InChI

InChI=1S/C23H23NO7S/c1-13-19(30-11-20(25)24-18(12-32-3)23(27)28)9-8-16-17(10-21(26)31-22(13)16)14-4-6-15(29-2)7-5-14/h4-10,18H,11-12H2,1-3H3,(H,24,25)(H,27,28)