3-bromanyl-N-butyl-5-ethenyl-4-nitro-2-oxidanyl-benzamide

Systemtic Name: 3-bromanyl-N-butyl-5-ethenyl-4-nitro-2-oxidanyl-benzamide Openeye Name: 3-bromo-N-butyl-2-hydroxy-4-nitro-5-vinyl-benzamide CAS Name: 3-bromo-N-butyl-5-ethenyl-2-hydroxy-4-nitrobenzamide IUPAC Name: 3-bromo-N-butyl-5-ethenyl-2-hydroxy-4-nitrobenzamide Traditional Name: 3-bromo-N-butyl-2-hydroxy-4-nitro-5-vinyl-benzamide Formula: C13H15BrN2O4 MolecularWeight: 343.1732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O4/c1-3-5-6-15-13(18)9-7-8(4-2)11(16(19)20)10(14)12(9)17/h4,7,17H,2-3,5-6H2,1H3,(H,15,18)