2-[[4-bromanyl-3-(4-chlorophenyl)azanidylsulfonyl-phenyl]carbonylamino]benzoate

Systemtic Name: 2-[[4-bromanyl-3-(4-chlorophenyl)azanidylsulfonyl-phenyl]carbonylamino]benzoate Openeye Name: 2-[[4-bromo-3-(4-chlorophenyl)azanidylsulfonyl-benzoyl]amino]benzoate CAS Name: 2-[[[4-bromo-3-(4-chlorophenyl)azanidylsulfonylphenyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[[4-bromo-3-(4-chlorophenyl)azanidylsulfonylbenzoyl]amino]benzoate Traditional Name: 2-[[4-bromo-3-(4-chlorophenyl)azanidylsulfonyl-benzoyl]amino]benzoate Formula: C20H12BrClN2O5S-2 MolecularWeight: 507.74168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)[N-]C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)[N-]C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H13BrClN2O5S/c21-16-10-5-12(19(25)23-17-4-2-1-3-15(17)20(26)27)11-18(16)30(28,29)24-14-8-6-13(22)7-9-14/h1-11H,(H,23,25)(H,26,27)/q-1/p-1