Chemical identification
CAS identifier989-38-8
Pubchem identifier13806
DSSTox identifierDTXSID1021243
IUPAC name[9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium chloride
StructureRhodamine 6G

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
SMILESCCOC(=O)c1ccccc1c1c2-c(oc3c1cc(C)c(c3)NCC)c/c(=[NH+]CC)/c(c2)C.[Cl-]
InChIInChI=1S/C28H30N2O3.ClH/c1-6-29-23-15-25-21(13-17(23)4)27(19-11-9-10-12-20(19)28(31)32-8-3)22-14-18(5)24(30-7-2)16-26(22)33-25;/h9-16,29H,6-8H2,1-5H3;1H/b30-24+;
InChIKeyVYXSBFYARXAAKO-WTKGSRSZSA-N

Chemical classification
KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassBenzopyrans
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