2-[(Z)-(7-oxidanyl-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]benzene-1,4-diol chloride

Systemtic Name: 2-[(Z)-(7-oxidanyl-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]benzene-1,4-diol chloride Openeye Name: 2-[(Z)-(7-hydroxy-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]benzene-1,4-diol chloride CAS Name: 2-[(Z)-(7-hydroxy-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]benzene-1,4-diol chloride IUPAC Name: 2-[(Z)-(7-hydroxy-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]benzene-1,4-diol chloride Traditional Name: 2-[(Z)-(7-hydroxy-2,3-dihydro-1H-xanthen-10-ium-4-ylidene)methyl]hydroquinone chloride Formula: C20H17ClO4 MolecularWeight: 356.79958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC3=C(C=CC(=C3)O)O)C1)[O+]=C4C=CC(=CC4=C2)O.[Cl-]

Isomeric SMILES

C1CC2=C(/C(=C\C3=C(C=CC(=C3)O)O)/C1)[O+]=C4C=CC(=CC4=C2)O.[Cl-]

InChI

InChI=1S/C20H16O4.ClH/c21-16-4-6-18(23)14(10-16)8-12-2-1-3-13-9-15-11-17(22)5-7-19(15)24-20(12)13;/h4-11H,1-3H2,(H2-,21,22,23);1H/b12-8-;