2-[[9-(2-methylsulfonyloxyethylamino)-5,10-bis(oxidanylidene)benzo[g]quinolin-6-yl]amino]ethyl methanesulfonate

Systemtic Name: 2-[[9-(2-methylsulfonyloxyethylamino)-5,10-bis(oxidanylidene)benzo[g]quinolin-6-yl]amino]ethyl methanesulfonate Openeye Name: 2-[[9-(2-methylsulfonyloxyethylamino)-5,10-dioxo-benzo[g]quinolin-6-yl]amino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[[9-(2-methylsulfonyloxyethylamino)-5,10-dioxo-6-benzo[g]quinolinyl]amino]ethyl ester IUPAC Name: 2-[[9-(2-methylsulfonyloxyethylamino)-5,10-dioxobenzo[g]quinolin-6-yl]amino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[[5,10-diketo-9-(2-methylsulfonyloxyethylamino)benzo[g]quinolin-6-yl]amino]ethyl ester Formula: C19H21N3O8S2 MolecularWeight: 483.51534

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCNC1=C2C(=C(C=C1)NCCOS(=O)(=O)C)C(=O)C3=C(C2=O)C=CC=N3

Isomeric SMILES

CS(=O)(=O)OCCNC1=C2C(=C(C=C1)NCCOS(=O)(=O)C)C(=O)C3=C(C2=O)C=CC=N3

InChI

InChI=1S/C19H21N3O8S2/c1-31(25,26)29-10-8-20-13-5-6-14(21-9-11-30-32(2,27)28)16-15(13)18(23)12-4-3-7-22-17(12)19(16)24/h3-7,20-21H,8-11H2,1-2H3