N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-2,4-dinitro-aniline

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-2,4-dinitro-aniline Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-2,4-dinitro-aniline CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-2,4-dinitroaniline IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-2,4-dinitroaniline Traditional Name: (5-bromo-2-methoxy-benzyl)-(2,4-dinitrophenyl)-methyl-amine Formula: C15H14BrN3O5 MolecularWeight: 396.19276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrN3O5/c1-17(9-10-7-11(16)3-6-15(10)24-2)13-5-4-12(18(20)21)8-14(13)19(22)23/h3-8H,9H2,1-2H3