[6-(diethylamino)-9-(4-methoxyphenyl)-10,10-bis(oxidanylidene)thioxanthen-3-ylidene]-diethyl-azanium

Systemtic Name: [6-(diethylamino)-9-(4-methoxyphenyl)-10,10-bis(oxidanylidene)thioxanthen-3-ylidene]-diethyl-azanium Openeye Name: [6-(diethylamino)-9-(4-methoxyphenyl)-10,10-dioxo-thioxanthen-3-ylidene]-diethyl-ammonium CAS Name: [6-(diethylamino)-9-(4-methoxyphenyl)-10,10-dioxo-3-thioxanthenylidene]-diethylammonium IUPAC Name: [6-(diethylamino)-9-(4-methoxyphenyl)-10,10-dioxothioxanthen-3-ylidene]-diethylazanium Traditional Name: [6-(diethylamino)-10,10-diketo-9-(4-methoxyphenyl)thioxanthen-3-ylidene]-diethyl-ammonium Formula: C28H33N2O3S+ MolecularWeight: 477.63822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3S2(=O)=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3S2(=O)=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H33N2O3S/c1-6-29(7-2)21-12-16-24-26(18-21)34(31,32)27-19-22(30(8-3)9-4)13-17-25(27)28(24)20-10-14-23(33-5)15-11-20/h10-19H,6-9H2,1-5H3/q+1