ethyl 4-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoate

Systemtic Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoate Openeye Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoate CAS Name: 4-[[3-[(4-bromophenyl)sulfonylamino]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoate Traditional Name: 4-[3-(brosylamino)propanoylamino]benzoic acid ethyl ester Formula: C18H19BrN2O5S MolecularWeight: 455.32286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H19BrN2O5S/c1-2-26-18(23)13-3-7-15(8-4-13)21-17(22)11-12-20-27(24,25)16-9-5-14(19)6-10-16/h3-10,20H,2,11-12H2,1H3,(H,21,22)