3-[2-acetamidoethyl(methyl)sulfonio]-7-methoxy-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-[2-acetamidoethyl(methyl)sulfonio]-7-methoxy-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[2-acetamidoethyl(methyl)sulfonio]-7-methoxy-4-oxo-chromen-2-olate CAS Name: 3-[2-acetamidoethyl(methyl)sulfonio]-7-methoxy-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[2-acetamidoethyl(methyl)sulfonio]-7-methoxy-4-oxochromen-2-olate Traditional Name: 3-[2-acetamidoethyl(methyl)sulfonio]-4-keto-7-methoxy-chromen-2-olate Formula: C15H17NO5S MolecularWeight: 323.36418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC[S+](C)C1=C(OC2=C(C1=O)C=CC(=C2)OC)[O-]

Isomeric SMILES

CC(=O)NCC[S+](C)C1=C(OC2=C(C1=O)C=CC(=C2)OC)[O-]

InChI

InChI=1S/C15H17NO5S/c1-9(17)16-6-7-22(3)14-13(18)11-5-4-10(20-2)8-12(11)21-15(14)19/h4-5,8H,6-7H2,1-3H3,(H-,16,17,18,19)