methyl 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-4-(phenylmethyl)sulfonyl-butanoate

Systemtic Name: methyl 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-4-(phenylmethyl)sulfonyl-butanoate Openeye Name: methyl 4-benzylsulfonyl-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]butanoate CAS Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-4-(phenylmethyl)sulfonylbutanoic acid methyl ester IUPAC Name: methyl 4-benzylsulfonyl-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]butanoate Traditional Name: 4-benzylsulfonyl-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]butyric acid methyl ester Formula: C24H24BrNO6S2 MolecularWeight: 566.48446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCS(=O)(=O)CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C(CCS(=O)(=O)CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H24BrNO6S2/c1-32-24(27)23(15-16-33(28,29)17-18-5-3-2-4-6-18)26-34(30,31)22-13-9-20(10-14-22)19-7-11-21(25)12-8-19/h2-14,23,26H,15-17H2,1H3