N-[(4-bromophenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(4-bromophenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(4-bromophenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(4-bromophenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(4-bromophenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-bromobenzyl)-(4-mesyl-2-nitro-phenyl)-methyl-amine Formula: C15H15BrN2O4S MolecularWeight: 399.2596

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrN2O4S/c1-17(10-11-3-5-12(16)6-4-11)14-8-7-13(23(2,21)22)9-15(14)18(19)20/h3-9H,10H2,1-2H3