[6-(diethylamino)-9-[4-(hydroxymethyl)-2-methyl-phenyl]xanthen-3-ylidene]-diethyl-azanium

Systemtic Name: [6-(diethylamino)-9-[4-(hydroxymethyl)-2-methyl-phenyl]xanthen-3-ylidene]-diethyl-azanium Openeye Name: [6-(diethylamino)-9-[4-(hydroxymethyl)-2-methyl-phenyl]xanthen-3-ylidene]-diethyl-ammonium CAS Name: [6-(diethylamino)-9-[4-(hydroxymethyl)-2-methylphenyl]-3-xanthenylidene]-diethylammonium IUPAC Name: [6-(diethylamino)-9-[4-(hydroxymethyl)-2-methylphenyl]xanthen-3-ylidene]-diethylazanium Traditional Name: [6-(diethylamino)-9-(2-methyl-4-methylol-phenyl)xanthen-3-ylidene]-diethyl-ammonium Formula: C29H35N2O2+ MolecularWeight: 443.6004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)CO)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)CO)C

InChI

InChI=1S/C29H35N2O2/c1-6-30(7-2)22-11-14-25-27(17-22)33-28-18-23(31(8-3)9-4)12-15-26(28)29(25)24-13-10-21(19-32)16-20(24)5/h10-18,32H,6-9,19H2,1-5H3/q+1