N-(2-bromoethyl)-4-(4-nitrophenyl)sulfonyl-aniline

Systemtic Name: N-(2-bromoethyl)-4-(4-nitrophenyl)sulfonyl-aniline Openeye Name: N-(2-bromoethyl)-4-(4-nitrophenyl)sulfonyl-aniline CAS Name: N-(2-bromoethyl)-4-(4-nitrophenyl)sulfonylaniline IUPAC Name: N-(2-bromoethyl)-4-(4-nitrophenyl)sulfonylaniline Traditional Name: 2-bromoethyl-(4-nosylphenyl)amine Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCBr)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCBr)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13BrN2O4S/c15-9-10-16-11-1-5-13(6-2-11)22(20,21)14-7-3-12(4-8-14)17(18)19/h1-8,16H,9-10H2