(E)-2-isoquinolin-2-ium-2-yl-1-methoxy-2-[(5Z)-5-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]ethenolate

Systemtic Name: (E)-2-isoquinolin-2-ium-2-yl-1-methoxy-2-[(5Z)-5-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]ethenolate Openeye Name: (E)-2-isoquinolin-2-ium-2-yl-1-methoxy-2-[(5Z)-5-(2-methoxy-2-oxo-ethylidene)-4-oxo-thiazol-2-yl]ethenolate CAS Name: (E)-2-(2-isoquinolin-2-iumyl)-1-methoxy-2-[(5Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-2-thiazolyl]ethenolate IUPAC Name: (E)-2-isoquinolin-2-ium-2-yl-1-methoxy-2-[(5Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-1,3-thiazol-2-yl]ethenolate Traditional Name: (E)-2-isoquinolin-2-ium-2-yl-2-[(5Z)-4-keto-5-(2-keto-2-methoxy-ethylidene)-2-thiazolin-2-yl]-1-methoxy-ethenolate Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1C(=O)N=C(S1)C(=C([O-])OC)[N+]2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)/C=C\1/C(=O)N=C(S1)/C(=C(/[O-])\OC)/[N+]2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H14N2O5S/c1-24-14(21)9-13-16(22)19-17(26-13)15(18(23)25-2)20-8-7-11-5-3-4-6-12(11)10-20/h3-10H,1-2H3/b13-9-