(4-methanoyl-2-methoxy-phenyl) 1-oxidanylideneisothiochromene-3-carboxylate

Systemtic Name: (4-methanoyl-2-methoxy-phenyl) 1-oxidanylideneisothiochromene-3-carboxylate Openeye Name: (4-formyl-2-methoxy-phenyl) 1-oxoisothiochromene-3-carboxylate CAS Name: 1-oxo-2-benzothiopyran-3-carboxylic acid (4-formyl-2-methoxyphenyl) ester IUPAC Name: (4-formyl-2-methoxyphenyl) 1-oxoisothiochromene-3-carboxylate Traditional Name: 1-ketoisothiochromene-3-carboxylic acid (4-formyl-2-methoxy-phenyl) ester Formula: C18H12O5S MolecularWeight: 340.34988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OC(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OC(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C18H12O5S/c1-22-15-8-11(10-19)6-7-14(15)23-17(20)16-9-12-4-2-3-5-13(12)18(21)24-16/h2-10H,1H3