2-(5-nitro-9-oxidanylidene-xanthen-4-yl)ethanoic acid; sodium

Systemtic Name: 2-(5-nitro-9-oxidanylidene-xanthen-4-yl)ethanoic acid; sodium Openeye Name: 2-(5-nitro-9-oxo-xanthen-4-yl)acetic acid; sodium CAS Name: 2-(5-nitro-9-oxo-4-xanthenyl)acetic acid; sodium IUPAC Name: 2-(5-nitro-9-oxoxanthen-4-yl)acetic acid; sodium Traditional Name: 2-(9-keto-5-nitro-xanthen-4-yl)acetic acid; sodium Formula: C15H9NNaO6 MolecularWeight: 322.22483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CC(=O)O)OC3=C(C2=O)C=CC=C3[N+](=O)[O-].[Na]

Isomeric SMILES

C1=CC2=C(C(=C1)CC(=O)O)OC3=C(C2=O)C=CC=C3[N+](=O)[O-].[Na]

InChI

InChI=1S/C15H9NO6.Na/c17-12(18)7-8-3-1-4-9-13(19)10-5-2-6-11(16(20)21)15(10)22-14(8)9;/h1-6H,7H2,(H,17,18);