N-[(5-chloranyl-4-nitro-2-oxidanyl-phenyl)methyl]-2-methyl-butanamide

Systemtic Name: N-[(5-chloranyl-4-nitro-2-oxidanyl-phenyl)methyl]-2-methyl-butanamide Openeye Name: N-[(5-chloro-2-hydroxy-4-nitro-phenyl)methyl]-2-methyl-butanamide CAS Name: N-[(5-chloro-2-hydroxy-4-nitrophenyl)methyl]-2-methylbutanamide IUPAC Name: N-[(5-chloro-2-hydroxy-4-nitrophenyl)methyl]-2-methylbutanamide Traditional Name: N-(5-chloro-2-hydroxy-4-nitro-benzyl)-2-methyl-butyramide Formula: C12H15ClN2O4 MolecularWeight: 286.7115

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1=CC(=C(C=C1O)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(C)C(=O)NCC1=CC(=C(C=C1O)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H15ClN2O4/c1-3-7(2)12(17)14-6-8-4-9(13)10(15(18)19)5-11(8)16/h4-5,7,16H,3,6H2,1-2H3,(H,14,17)