2-[(4-bromophenyl)-(4-chloranyl-3-nitro-phenyl)sulfonyl-amino]-N-propyl-ethanamide

Systemtic Name: 2-[(4-bromophenyl)-(4-chloranyl-3-nitro-phenyl)sulfonyl-amino]-N-propyl-ethanamide Openeye Name: 2-(4-bromo-N-(4-chloro-3-nitro-phenyl)sulfonyl-anilino)-N-propyl-acetamide CAS Name: 2-(4-bromo-N-(4-chloro-3-nitrophenyl)sulfonylanilino)-N-propylacetamide IUPAC Name: 2-(4-bromo-N-(4-chloro-3-nitrophenyl)sulfonylanilino)-N-propylacetamide Traditional Name: 2-(4-bromo-N-(4-chloro-3-nitro-phenyl)sulfonyl-anilino)-N-propyl-acetamide Formula: C17H17BrClN3O5S MolecularWeight: 490.75598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrClN3O5S/c1-2-9-20-17(23)11-21(13-5-3-12(18)4-6-13)28(26,27)14-7-8-15(19)16(10-14)22(24)25/h3-8,10H,2,9,11H2,1H3,(H,20,23)