1,2,3-tris(chloranyl)-4-hexan-3-yl-5-isocyano-benzene

Systemtic Name: 1,2,3-tris(chloranyl)-4-hexan-3-yl-5-isocyano-benzene Openeye Name: 1,2,3-trichloro-4-(1-ethylbutyl)-5-isocyano-benzene CAS Name: 1,2,3-trichloro-4-hexan-3-yl-5-isocyanobenzene IUPAC Name: 1,2,3-trichloro-4-hexan-3-yl-5-isocyanobenzene Traditional Name: 1,2,3-trichloro-4-(1-ethylbutyl)-5-isocyano-benzene Formula: C13H14Cl3N MolecularWeight: 290.61596

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C1=C(C(=C(C=C1[N+]#[C-])Cl)Cl)Cl

Isomeric SMILES

CCCC(CC)C1=C(C(=C(C=C1[N+]#[C-])Cl)Cl)Cl

InChI

InChI=1S/C13H14Cl3N/c1-4-6-8(5-2)11-10(17-3)7-9(14)12(15)13(11)16/h7-8H,4-6H2,1-2H3