2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[benzyl-(4-bromophenyl)sulfonyl-amino]-N-(3-nitrophenyl)acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[benzyl-(4-bromophenyl)sulfonylamino]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[benzyl(brosyl)amino]-N-(3-nitrophenyl)acetamide Formula: C21H18BrN3O5S MolecularWeight: 504.35372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CN(CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O5S/c22-17-9-11-20(12-10-17)31(29,30)24(14-16-5-2-1-3-6-16)15-21(26)23-18-7-4-8-19(13-18)25(27)28/h1-13H,14-15H2,(H,23,26)