phenylmethanamine; 3,4,6-tris(chloranyl)-2-nitro-phenol

Systemtic Name: phenylmethanamine; 3,4,6-tris(chloranyl)-2-nitro-phenol Openeye Name: phenylmethanamine; 3,4,6-trichloro-2-nitro-phenol CAS Name: phenylmethanamine; 3,4,6-trichloro-2-nitrophenol IUPAC Name: phenylmethanamine; 3,4,6-trichloro-2-nitrophenol Traditional Name: benzylamine; 3,4,6-trichloro-2-nitro-phenol Formula: C13H11Cl3N2O3 MolecularWeight: 349.59704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9N.C6H2Cl3NO3/c8-6-7-4-2-1-3-5-7;7-2-1-3(8)6(11)5(4(2)9)10(12)13/h1-5H,6,8H2;1,11H