4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2-bromophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-bromophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-bromobenzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C14H14BrN3O4S MolecularWeight: 400.24766

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H14BrN3O4S/c1-17(9-10-4-2-3-5-12(10)15)13-7-6-11(23(16,21)22)8-14(13)18(19)20/h2-8H,9H2,1H3,(H2,16,21,22)