prop-2-en-1-amine; 3,4,6-tris(chloranyl)-2-nitro-phenol

Systemtic Name: prop-2-en-1-amine; 3,4,6-tris(chloranyl)-2-nitro-phenol Openeye Name: prop-2-en-1-amine; 3,4,6-trichloro-2-nitro-phenol CAS Name: 2-propen-1-amine; 3,4,6-trichloro-2-nitrophenol IUPAC Name: prop-2-en-1-amine; 3,4,6-trichloro-2-nitrophenol Traditional Name: allylamine; 3,4,6-trichloro-2-nitro-phenol Formula: C9H9Cl3N2O3 MolecularWeight: 299.53836

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN.C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])O)Cl

Isomeric SMILES

C=CCN.C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C6H2Cl3NO3.C3H7N/c7-2-1-3(8)6(11)5(4(2)9)10(12)13;1-2-3-4/h1,11H;2H,1,3-4H2