disodium 2-(3-methylidene-6-oxidanidyl-xanthen-9-yl)benzoate

Systemtic Name: disodium 2-(3-methylidene-6-oxidanidyl-xanthen-9-yl)benzoate Openeye Name: disodium 2-(3-methylene-6-oxido-xanthen-9-yl)benzoate CAS Name: disodium 2-(3-methylene-6-oxido-9-xanthenyl)benzoate IUPAC Name: disodium 2-(3-methylidene-6-oxidoxanthen-9-yl)benzoate Traditional Name: disodium 2-(3-methylene-6-oxido-xanthen-9-yl)benzoate Formula: C21H12Na2O4 MolecularWeight: 374.29712

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C=CC2=C(C3=C(C=C(C=C3)[O-])OC2=C1)C4=CC=CC=C4C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C=C1C=CC2=C(C3=C(C=C(C=C3)[O-])OC2=C1)C4=CC=CC=C4C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C21H14O4.2Na/c1-12-6-8-16-18(10-12)25-19-11-13(22)7-9-17(19)20(16)14-4-2-3-5-15(14)21(23)24;;/h2-11,22H,1H2,(H,23,24);;/q;2*+1/p-2