sodium (2E)-8-oxidanyl-2-[(2E)-2-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinoline-7-carboxylate

Systemtic Name: sodium (2E)-8-oxidanyl-2-[(2E)-2-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinoline-7-carboxylate Openeye Name: sodium (2E)-8-hydroxy-2-[(2E)-2-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinoline-7-carboxylate CAS Name: sodium (2E)-8-hydroxy-2-[(2E)-2-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-1H-quinoline-7-carboxylate IUPAC Name: sodium (2E)-8-hydroxy-2-[(2E)-2-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinoline-7-carboxylate Traditional Name: sodium (2E)-8-hydroxy-2-[(2E)-2-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinoline-7-carboxylate Formula: C18H12NNaO5 MolecularWeight: 345.28135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C2C=CC(=O)C(=C2)O)NC3=C1C=CC(=C3O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=C/C(=C\C=C\2/C=CC(=O)C(=C2)O)/NC3=C1C=CC(=C3O)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H13NO5.Na/c20-14-8-2-10(9-15(14)21)1-5-12-6-3-11-4-7-13(18(23)24)17(22)16(11)19-12;/h1-9,19,21-22H,(H,23,24);/q;+1/p-1/b10-1+,12-5+;