methyl 2-isoquinolin-2-ium-2-yl-2-[(5Z)-5-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoate

Systemtic Name: methyl 2-isoquinolin-2-ium-2-yl-2-[(5Z)-5-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoate Openeye Name: methyl 2-isoquinolin-2-ium-2-yl-2-[(5Z)-5-(2-methoxy-2-oxo-ethylidene)-4-oxo-thiazolidin-2-ylidene]acetate CAS Name: 2-(2-isoquinolin-2-iumyl)-2-[(5Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-2-thiazolidinylidene]acetic acid methyl ester IUPAC Name: methyl 2-isoquinolin-2-ium-2-yl-2-[(5Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-1,3-thiazolidin-2-ylidene]acetate Traditional Name: 2-isoquinolin-2-ium-2-yl-2-[(5Z)-4-keto-5-(2-keto-2-methoxy-ethylidene)thiazolidin-2-ylidene]acetic acid methyl ester Formula: C18H15N2O5S+ MolecularWeight: 371.3871

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/p+1/b13-9-