2-nitro-N-[(E)-3-oxidanylhex-4-en-2-yl]benzamide

Systemtic Name: 2-nitro-N-[(E)-3-oxidanylhex-4-en-2-yl]benzamide Openeye Name: N-[(E)-2-hydroxy-1-methyl-pent-3-enyl]-2-nitro-benzamide CAS Name: N-[(E)-3-hydroxyhex-4-en-2-yl]-2-nitrobenzamide IUPAC Name: N-[(E)-3-hydroxyhex-4-en-2-yl]-2-nitrobenzamide Traditional Name: N-[(E)-2-hydroxy-1-methyl-pent-3-enyl]-2-nitro-benzamide Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C/C(C(C)NC(=O)C1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C13H16N2O4/c1-3-6-12(16)9(2)14-13(17)10-7-4-5-8-11(10)15(18)19/h3-9,12,16H,1-2H3,(H,14,17)/b6-3+