5-[2-methyl-7-[(2-methyl-1,3-thiazol-4-yl)methoxy]-4-oxidanylidene-chromen-3-yl]furan-2-carboxylic acid

Systemtic Name: 5-[2-methyl-7-[(2-methyl-1,3-thiazol-4-yl)methoxy]-4-oxidanylidene-chromen-3-yl]furan-2-carboxylic acid Openeye Name: 5-[2-methyl-7-[(2-methylthiazol-4-yl)methoxy]-4-oxo-chromen-3-yl]furan-2-carboxylic acid CAS Name: 5-[2-methyl-7-[(2-methyl-4-thiazolyl)methoxy]-4-oxo-1-benzopyran-3-yl]-2-furancarboxylic acid IUPAC Name: 5-[2-methyl-7-[(2-methyl-1,3-thiazol-4-yl)methoxy]-4-oxochromen-3-yl]furan-2-carboxylic acid Traditional Name: 5-[4-keto-2-methyl-7-[(2-methylthiazol-4-yl)methoxy]chromen-3-yl]-2-furoic acid Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=CSC(=N3)C)C4=CC=C(O4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=CSC(=N3)C)C4=CC=C(O4)C(=O)O

InChI

InChI=1S/C20H15NO6S/c1-10-18(15-5-6-16(27-15)20(23)24)19(22)14-4-3-13(7-17(14)26-10)25-8-12-9-28-11(2)21-12/h3-7,9H,8H2,1-2H3,(H,23,24)