2-[(2R,3E)-3-[[(4-methoxyphenyl)amino]methylidene]-6-methyl-4-oxidanylidene-chromen-2-yl]sulfanylethanoate

Systemtic Name: 2-[(2R,3E)-3-[[(4-methoxyphenyl)amino]methylidene]-6-methyl-4-oxidanylidene-chromen-2-yl]sulfanylethanoate Openeye Name: 2-[(2R,3E)-3-[(4-methoxyanilino)methylene]-6-methyl-4-oxo-chroman-2-yl]sulfanylacetate CAS Name: 2-[[(2R,3E)-3-[(4-methoxyanilino)methylidene]-6-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]thio]acetate IUPAC Name: 2-[(2R,3E)-3-[(4-methoxyanilino)methylidene]-6-methyl-4-oxochromen-2-yl]sulfanylacetate Traditional Name: 2-[[(2R,3E)-4-keto-6-methyl-3-(p-anisidinomethylene)chroman-2-yl]thio]acetate Formula: C20H18NO5S- MolecularWeight: 384.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(C(=CNC3=CC=C(C=C3)OC)C2=O)SCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@@H](/C(=C/NC3=CC=C(C=C3)OC)/C2=O)SCC(=O)[O-]

InChI

InChI=1S/C20H19NO5S/c1-12-3-8-17-15(9-12)19(24)16(20(26-17)27-11-18(22)23)10-21-13-4-6-14(25-2)7-5-13/h3-10,20-21H,11H2,1-2H3,(H,22,23)/p-1/b16-10+/t20-/m1/s1