(E)-1,1,1-tris(chloranyl)-4-[[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-methyl-amino]-3-nitro-but-3-en-2-ol

Systemtic Name: (E)-1,1,1-tris(chloranyl)-4-[[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-methyl-amino]-3-nitro-but-3-en-2-ol Openeye Name: (E)-1,1,1-trichloro-4-[[(6-chloro-3-pyridyl)methyl-ethyl-amino]-methyl-amino]-3-nitro-but-3-en-2-ol CAS Name: (E)-1,1,1-trichloro-4-[[(6-chloro-3-pyridinyl)methyl-ethylamino]-methylamino]-3-nitro-3-buten-2-ol IUPAC Name: (E)-1,1,1-trichloro-4-[[(6-chloropyridin-3-yl)methyl-ethylamino]-methylamino]-3-nitrobut-3-en-2-ol Traditional Name: (E)-1,1,1-trichloro-4-[[(6-chloro-3-pyridyl)methyl-ethyl-amino]-methyl-amino]-3-nitro-but-3-en-2-ol Formula: C13H16Cl4N4O3 MolecularWeight: 418.10314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CN=C(C=C1)Cl)N(C)C=C(C(C(Cl)(Cl)Cl)O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CN=C(C=C1)Cl)N(C)/C=C(\C(C(Cl)(Cl)Cl)O)/[N+](=O)[O-]

InChI

InChI=1S/C13H16Cl4N4O3/c1-3-20(7-9-4-5-11(14)18-6-9)19(2)8-10(21(23)24)12(22)13(15,16)17/h4-6,8,12,22H,3,7H2,1-2H3/b10-8+