4-chloranyl-2,3,5-trideuterio-6-nitro-aniline

Systemtic Name: 4-chloranyl-2,3,5-trideuterio-6-nitro-aniline Openeye Name: 4-chloro-2,3,5-trideuterio-6-nitro-aniline CAS Name: 4-chloro-2,3,5-trideuterio-6-nitroaniline IUPAC Name: 4-chloro-2,3,5-trideuterio-6-nitroaniline Traditional Name: (4-chloro-2,3,5-trideuterio-6-nitro-phenyl)amine Formula: C6H5ClN2O2 MolecularWeight: 175.587585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])N

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1N)[N+](=O)[O-])[2H])Cl)[2H]

InChI

InChI=1S/C6H5ClN2O2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H,8H2/i1D,2D,3D