sodium [4-[1-(4-hydroxyphenyl)-3-oxidanylidene-2-benzofuran-1-yl]phenyl] hydrogen carbonate

Systemtic Name: sodium [4-[1-(4-hydroxyphenyl)-3-oxidanylidene-2-benzofuran-1-yl]phenyl] hydrogen carbonate Openeye Name: sodium [4-[1-(4-hydroxyphenyl)-3-oxo-isobenzofuran-1-yl]phenyl] hydrogen carbonate CAS Name: sodium carbonic acid [4-[1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl] ester IUPAC Name: sodium [4-[1-(4-hydroxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] hydrogen carbonate Traditional Name: sodium carbonic acid [4-[1-(4-hydroxyphenyl)-3-keto-phthalan-1-yl]phenyl] ester Formula: C21H14NaO6+ MolecularWeight: 385.32203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OC(=O)O.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OC(=O)O.[Na+]

InChI

InChI=1S/C21H14O6.Na/c22-15-9-5-13(6-10-15)21(14-7-11-16(12-8-14)26-20(24)25)18-4-2-1-3-17(18)19(23)27-21;/h1-12,22H,(H,24,25);/q;+1