bis[2,4-bis(bromanyl)-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] ethanedioate

Systemtic Name: bis[2,4-bis(bromanyl)-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] ethanedioate Openeye Name: bis[2,4-dibromo-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] oxalate CAS Name: oxalic acid bis[2,4-dibromo-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] ester IUPAC Name: bis[2,4-dibromo-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] oxalate Traditional Name: oxalic acid bis[2,4-dibromo-6-[2-dimethylaminoethyl(hexyl)sulfamoyl]phenyl] ester Formula: C34H50Br4N4O8S2 MolecularWeight: 1026.5288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCN(C)C)S(=O)(=O)C1=CC(=CC(=C1OC(=O)C(=O)OC2=C(C=C(C=C2S(=O)(=O)N(CCCCCC)CCN(C)C)Br)Br)Br)Br

Isomeric SMILES

CCCCCCN(CCN(C)C)S(=O)(=O)C1=CC(=CC(=C1OC(=O)C(=O)OC2=C(C=C(C=C2S(=O)(=O)N(CCCCCC)CCN(C)C)Br)Br)Br)Br

InChI

InChI=1S/C34H50Br4N4O8S2/c1-7-9-11-13-15-41(19-17-39(3)4)51(45,46)29-23-25(35)21-27(37)31(29)49-33(43)34(44)50-32-28(38)22-26(36)24-30(32)52(47,48)42(20-18-40(5)6)16-14-12-10-8-2/h21-24H,7-20H2,1-6H3