2-azaniumyl-5,5,5-tris(chloranyl)-4-methyl-pentanoate

Systemtic Name: 2-azaniumyl-5,5,5-tris(chloranyl)-4-methyl-pentanoate Openeye Name: 2-azaniumyl-5,5,5-trichloro-4-methyl-pentanoate CAS Name: 2-ammonio-5,5,5-trichloro-4-methylpentanoate IUPAC Name: 2-azaniumyl-5,5,5-trichloro-4-methylpentanoate Traditional Name: 2-ammonio-5,5,5-trichloro-4-methyl-valerate Formula: C6H10Cl3NO2 MolecularWeight: 235.500755

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)[O-])[NH3+])C(Cl)(Cl)Cl

Isomeric SMILES

CC(C[13CH](C(=O)[O-])[NH3+])C(Cl)(Cl)Cl

InChI

InChI=1S/C6H10Cl3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/i4+1