methyl phenoxathiine-3-carboxylate

Systemtic Name: methyl phenoxathiine-3-carboxylate Openeye Name: methyl phenoxathiine-3-carboxylate CAS Name: 3-phenoxathiinecarboxylic acid methyl ester IUPAC Name: methyl phenoxathiine-3-carboxylate Traditional Name: phenoxathiine-3-carboxylic acid methyl ester Formula: C14H10O3S MolecularWeight: 258.2924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3O2

InChI

InChI=1S/C14H10O3S/c1-16-14(15)9-6-7-13-11(8-9)17-10-4-2-3-5-12(10)18-13/h2-8H,1H3