bis[2,3-bis(bromanyl)-6-[2-dimethylaminoethyl(propan-2-yl)sulfamoyl]phenyl] ethanedioate

Systemtic Name: bis[2,3-bis(bromanyl)-6-[2-dimethylaminoethyl(propan-2-yl)sulfamoyl]phenyl] ethanedioate Openeye Name: bis[2,3-dibromo-6-[2-dimethylaminoethyl(isopropyl)sulfamoyl]phenyl] oxalate CAS Name: oxalic acid bis[2,3-dibromo-6-[2-dimethylaminoethyl(propan-2-yl)sulfamoyl]phenyl] ester IUPAC Name: bis[2,3-dibromo-6-[2-dimethylaminoethyl(propan-2-yl)sulfamoyl]phenyl] oxalate Traditional Name: oxalic acid bis[2,3-dibromo-6-[2-dimethylaminoethyl(isopropyl)sulfamoyl]phenyl] ester Formula: C28H38Br4N4O8S2 MolecularWeight: 942.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN(C)C)S(=O)(=O)C1=C(C(=C(C=C1)Br)Br)OC(=O)C(=O)OC2=C(C=CC(=C2Br)Br)S(=O)(=O)N(CCN(C)C)C(C)C

Isomeric SMILES

CC(C)N(CCN(C)C)S(=O)(=O)C1=C(C(=C(C=C1)Br)Br)OC(=O)C(=O)OC2=C(C=CC(=C2Br)Br)S(=O)(=O)N(CCN(C)C)C(C)C

InChI

InChI=1S/C28H38Br4N4O8S2/c1-17(2)35(15-13-33(5)6)45(39,40)21-11-9-19(29)23(31)25(21)43-27(37)28(38)44-26-22(12-10-20(30)24(26)32)46(41,42)36(18(3)4)16-14-34(7)8/h9-12,17-18H,13-16H2,1-8H3