3-(3-hydroxyphenyl)-3,4-dihydro-2H-chromen-1-ium-5,7-diol chloride

Systemtic Name: 3-(3-hydroxyphenyl)-3,4-dihydro-2H-chromen-1-ium-5,7-diol chloride Openeye Name: 3-(3-hydroxyphenyl)chroman-1-ium-5,7-diol chloride CAS Name: 3-(3-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-1-ium-5,7-diol chloride IUPAC Name: 3-(3-hydroxyphenyl)-3,4-dihydro-2H-chromen-1-ium-5,7-diol chloride Traditional Name: 3-(3-hydroxyphenyl)chroman-1-ium-5,7-diol chloride Formula: C15H15ClO4 MolecularWeight: 294.7302

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[OH+]C2=CC(=CC(=C21)O)O)C3=CC(=CC=C3)O.[Cl-]

Isomeric SMILES

C1C(C[OH+]C2=CC(=CC(=C21)O)O)C3=CC(=CC=C3)O.[Cl-]

InChI

InChI=1S/C15H14O4.ClH/c16-11-3-1-2-9(4-11)10-5-13-14(18)6-12(17)7-15(13)19-8-10;/h1-4,6-7,10,16-18H,5,8H2;1H