N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline Traditional Name: (5-bromo-2-methoxy-benzyl)-(4-mesyl-2-nitro-phenyl)-methyl-amine Formula: C16H17BrN2O5S MolecularWeight: 429.28558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN2O5S/c1-18(10-11-8-12(17)4-7-16(11)24-2)14-6-5-13(25(3,22)23)9-15(14)19(20)21/h4-9H,10H2,1-3H3