sodium methyl 2-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-4-oxidanyl-quinolin-1-ide-7-carboxylate

Systemtic Name: sodium methyl 2-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-4-oxidanyl-quinolin-1-ide-7-carboxylate Openeye Name: sodium methyl 2-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)-4-hydroxy-quinolin-1-ide-7-carboxylate CAS Name: sodium 2-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-hydroxy-7-quinolin-1-idecarboxylic acid methyl ester IUPAC Name: sodium methyl 2-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-hydroxyquinolin-1-ide-7-carboxylate Traditional Name: sodium 2-(2,6-diketo-4,4-dimethyl-cyclohexylidene)-4-hydroxy-quinolin-1-ide-7-carboxylic acid methyl ester Formula: C19H18NNaO5 MolecularWeight: 363.33969

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C2C=C(C3=C([N-]2)C=C(C=C3)C(=O)OC)O)C(=O)C1)C.[Na+]

Isomeric SMILES

CC1(CC(=O)C(=C2C=C(C3=C([N-]2)C=C(C=C3)C(=O)OC)O)C(=O)C1)C.[Na+]

InChI

InChI=1S/C19H19NO5.Na/c1-19(2)8-15(22)17(16(23)9-19)13-7-14(21)11-5-4-10(18(24)25-3)6-12(11)20-13;/h4-7H,8-9H2,1-3H3,(H2,20,21,22,23);/q;+1/p-1