sodium [4-[5,7-bis(oxidanyl)-4-oxidanylidene-2,3-dihydrochromen-2-yl]phenyl] hydrogen phosphate

Systemtic Name: sodium [4-[5,7-bis(oxidanyl)-4-oxidanylidene-2,3-dihydrochromen-2-yl]phenyl] hydrogen phosphate Openeye Name: sodium [4-(5,7-dihydroxy-4-oxo-chroman-2-yl)phenyl] hydrogen phosphate CAS Name: sodium [4-(5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl] hydrogen phosphate IUPAC Name: sodium [4-(5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl)phenyl] hydrogen phosphate Traditional Name: sodium [4-(5,7-dihydroxy-4-keto-chroman-2-yl)phenyl] hydrogen phosphate Formula: C15H12NaO8P MolecularWeight: 374.214511

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)OP(=O)(O)[O-].[Na+]

Isomeric SMILES

C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)OP(=O)(O)[O-].[Na+]

InChI

InChI=1S/C15H13O8P.Na/c16-9-5-11(17)15-12(18)7-13(22-14(15)6-9)8-1-3-10(4-2-8)23-24(19,20)21;/h1-6,13,16-17H,7H2,(H2,19,20,21);/q;+1/p-1