N-(butylcarbamoyl)-6-chloranyl-2-nitro-3,4-bis(oxidanyl)benzamide

Systemtic Name: N-(butylcarbamoyl)-6-chloranyl-2-nitro-3,4-bis(oxidanyl)benzamide Openeye Name: N-(butylcarbamoyl)-6-chloro-3,4-dihydroxy-2-nitro-benzamide CAS Name: N-[butylamino(oxo)methyl]-6-chloro-3,4-dihydroxy-2-nitrobenzamide IUPAC Name: N-(butylcarbamoyl)-6-chloro-3,4-dihydroxy-2-nitrobenzamide Traditional Name: N-(butylcarbamoyl)-6-chloro-3,4-dihydroxy-2-nitro-benzamide Formula: C12H14ClN3O6 MolecularWeight: 331.70906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

Isomeric SMILES

CCCCNC(=O)NC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

InChI

InChI=1S/C12H14ClN3O6/c1-2-3-4-14-12(20)15-11(19)8-6(13)5-7(17)10(18)9(8)16(21)22/h5,17-18H,2-4H2,1H3,(H2,14,15,19,20)