3-nitro-N-[[2,3,6-tris(chloranyl)phenyl]methyl]aniline

Systemtic Name: 3-nitro-N-[[2,3,6-tris(chloranyl)phenyl]methyl]aniline Openeye Name: 3-nitro-N-[(2,3,6-trichlorophenyl)methyl]aniline CAS Name: 3-nitro-N-[(2,3,6-trichlorophenyl)methyl]aniline IUPAC Name: 3-nitro-N-[(2,3,6-trichlorophenyl)methyl]aniline Traditional Name: (3-nitrophenyl)-(2,3,6-trichlorobenzyl)amine Formula: C13H9Cl3N2O2 MolecularWeight: 331.58176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=C(C=CC(=C2Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=C(C=CC(=C2Cl)Cl)Cl

InChI

InChI=1S/C13H9Cl3N2O2/c14-11-4-5-12(15)13(16)10(11)7-17-8-2-1-3-9(6-8)18(19)20/h1-6,17H,7H2