(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-methyl-4-phenyl-thiazole-5-carboxylate CAS Name: 2-methyl-4-phenyl-5-thiazolecarboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-methyl-4-phenyl-thiazole-5-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C21H15NO5S MolecularWeight: 393.4125

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(S1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C21H15NO5S/c1-12-22-19(13-5-3-2-4-6-13)20(28-12)21(25)26-11-14-9-18(24)27-17-10-15(23)7-8-16(14)17/h2-10,23H,11H2,1H3