[9-(5-carboxythiophen-2-yl)-6-(dimethylamino)selenoxanthen-3-ylidene]-dimethyl-azanium

Systemtic Name: [9-(5-carboxythiophen-2-yl)-6-(dimethylamino)selenoxanthen-3-ylidene]-dimethyl-azanium Openeye Name: [9-(5-carboxy-2-thienyl)-6-(dimethylamino)selenoxanthen-3-ylidene]-dimethyl-ammonium CAS Name: [9-(5-carboxy-2-thiophenyl)-6-(dimethylamino)-3-selenoxanthenylidene]-dimethylammonium IUPAC Name: [9-(5-carboxythiophen-2-yl)-6-(dimethylamino)selenoxanthen-3-ylidene]-dimethylazanium Traditional Name: [9-(5-carboxy-2-thienyl)-6-(dimethylamino)selenoxanthen-3-ylidene]-dimethyl-ammonium Formula: C22H21N2O2SSe+ MolecularWeight: 456.43934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3[Se]2)C4=CC=C(S4)C(=O)O

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3[Se]2)C4=CC=C(S4)C(=O)O

InChI

InChI=1S/C22H20N2O2SSe/c1-23(2)13-5-7-15-19(11-13)28-20-12-14(24(3)4)6-8-16(20)21(15)17-9-10-18(27-17)22(25)26/h5-12H,1-4H3/p+1