2-acetamidoethyl-(7-methoxy-2-oxidanyl-4-oxidanylidene-chromen-3-yl)-methyl-sulfanium

Systemtic Name: 2-acetamidoethyl-(7-methoxy-2-oxidanyl-4-oxidanylidene-chromen-3-yl)-methyl-sulfanium Openeye Name: 2-acetamidoethyl-(2-hydroxy-7-methoxy-4-oxo-chromen-3-yl)-methyl-sulfonium CAS Name: 2-acetamidoethyl-(2-hydroxy-7-methoxy-4-oxo-1-benzopyran-3-yl)-methylsulfonium IUPAC Name: 2-acetamidoethyl-(2-hydroxy-7-methoxy-4-oxochromen-3-yl)-methylsulfanium Traditional Name: 2-acetamidoethyl-(2-hydroxy-4-keto-7-methoxy-chromen-3-yl)-methyl-sulfonium Formula: C15H18NO5S+ MolecularWeight: 324.37212

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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)/p+1