[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl methyl carbonate

Systemtic Name: [1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl methyl carbonate Openeye Name: [1-(2-diethylaminoethylamino)-9-oxo-thioxanthen-4-yl]methyl methyl carbonate CAS Name: carbonic acid [1-(2-diethylaminoethylamino)-9-oxo-4-thioxanthenyl]methyl methyl ester IUPAC Name: [1-(2-diethylaminoethylamino)-9-oxothioxanthen-4-yl]methyl methyl carbonate Traditional Name: carbonic acid [1-(2-diethylaminoethylamino)-9-keto-thioxanthen-4-yl]methyl methyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)COC(=O)OC)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)COC(=O)OC)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H26N2O4S/c1-4-24(5-2)13-12-23-17-11-10-15(14-28-22(26)27-3)21-19(17)20(25)16-8-6-7-9-18(16)29-21/h6-11,23H,4-5,12-14H2,1-3H3