[1-(2-dimethylaminoethylamino)-7-(methylcarbamoyloxy)-9-oxidanylidene-xanthen-4-yl]methyl N-methylcarbamate

Systemtic Name: [1-(2-dimethylaminoethylamino)-7-(methylcarbamoyloxy)-9-oxidanylidene-xanthen-4-yl]methyl N-methylcarbamate Openeye Name: [1-(2-dimethylaminoethylamino)-7-(methylcarbamoyloxy)-9-oxo-xanthen-4-yl]methyl N-methylcarbamate CAS Name: N-methylcarbamic acid [1-(2-dimethylaminoethylamino)-7-(methylcarbamoyloxy)-9-oxo-4-xanthenyl]methyl ester IUPAC Name: [1-(2-dimethylaminoethylamino)-7-(methylcarbamoyloxy)-9-oxoxanthen-4-yl]methyl N-methylcarbamate Traditional Name: N-methylcarbamic acid [1-(2-dimethylaminoethylamino)-9-keto-7-(methylcarbamoyloxy)xanthen-4-yl]methyl ester Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCC1=C2C(=C(C=C1)NCCN(C)C)C(=O)C3=C(O2)C=CC(=C3)OC(=O)NC

Isomeric SMILES

CNC(=O)OCC1=C2C(=C(C=C1)NCCN(C)C)C(=O)C3=C(O2)C=CC(=C3)OC(=O)NC

InChI

InChI=1S/C22H26N4O6/c1-23-21(28)30-12-13-5-7-16(25-9-10-26(3)4)18-19(27)15-11-14(31-22(29)24-2)6-8-17(15)32-20(13)18/h5-8,11,25H,9-10,12H2,1-4H3,(H,23,28)(H,24,29)