methyl (Z)-4-methoxy-4-oxidanyl-2-oxidanylidene-3-thieno[2,3-c]quinolin-5-ium-5-yl-but-3-enoate

Systemtic Name: methyl (Z)-4-methoxy-4-oxidanyl-2-oxidanylidene-3-thieno[2,3-c]quinolin-5-ium-5-yl-but-3-enoate Openeye Name: methyl (Z)-4-hydroxy-4-methoxy-2-oxo-3-thieno[2,3-c]quinolin-5-ium-5-yl-but-3-enoate CAS Name: (Z)-4-hydroxy-4-methoxy-2-oxo-3-(5-thieno[2,3-c]quinolin-5-iumyl)-3-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-hydroxy-4-methoxy-2-oxo-3-thieno[2,3-c]quinolin-5-ium-5-ylbut-3-enoate Traditional Name: (Z)-4-hydroxy-2-keto-4-methoxy-3-thieno[2,3-c]quinolin-5-ium-5-yl-but-3-enoic acid methyl ester Formula: C17H14NO5S+ MolecularWeight: 344.36176

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)C(=O)OC)[N+]1=CC2=C(C=CS2)C3=CC=CC=C31)O

Isomeric SMILES

CO/C(=C(/C(=O)C(=O)OC)\[N+]1=CC2=C(C=CS2)C3=CC=CC=C31)/O

InChI

InChI=1S/C17H13NO5S/c1-22-16(20)14(15(19)17(21)23-2)18-9-13-11(7-8-24-13)10-5-3-4-6-12(10)18/h3-9H,1-2H3/p+1