4-(4-bromophenyl)sulfonyl-3-nitro-N-phenethyl-benzamide

Systemtic Name: 4-(4-bromophenyl)sulfonyl-3-nitro-N-phenethyl-benzamide Openeye Name: 4-(4-bromophenyl)sulfonyl-3-nitro-N-phenethyl-benzamide CAS Name: 4-(4-bromophenyl)sulfonyl-3-nitro-N-phenethylbenzamide IUPAC Name: 4-(4-bromophenyl)sulfonyl-3-nitro-N-phenethylbenzamide Traditional Name: 4-brosyl-3-nitro-N-phenethyl-benzamide Formula: C21H17BrN2O5S MolecularWeight: 489.33908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN2O5S/c22-17-7-9-18(10-8-17)30(28,29)20-11-6-16(14-19(20)24(26)27)21(25)23-13-12-15-4-2-1-3-5-15/h1-11,14H,12-13H2,(H,23,25)