N-[4-bromanyl-2,6-bis(chloranyl)phenyl]-N-methyl-2,4,6-trinitro-aniline

Systemtic Name: N-[4-bromanyl-2,6-bis(chloranyl)phenyl]-N-methyl-2,4,6-trinitro-aniline Openeye Name: N-(4-bromo-2,6-dichloro-phenyl)-N-methyl-2,4,6-trinitro-aniline CAS Name: N-(4-bromo-2,6-dichlorophenyl)-N-methyl-2,4,6-trinitroaniline IUPAC Name: N-(4-bromo-2,6-dichlorophenyl)-N-methyl-2,4,6-trinitroaniline Traditional Name: (4-bromo-2,6-dichloro-phenyl)-methyl-picryl-amine Formula: C13H7BrCl2N4O6 MolecularWeight: 466.02788

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C2=C(C=C(C=C2Cl)Br)Cl

Isomeric SMILES

CN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C2=C(C=C(C=C2Cl)Br)Cl

InChI

InChI=1S/C13H7BrCl2N4O6/c1-17(12-8(15)2-6(14)3-9(12)16)13-10(19(23)24)4-7(18(21)22)5-11(13)20(25)26/h2-5H,1H3