N-[(2S)-2-ethylhexanoyl]-2-nitro-benzamide

Systemtic Name: N-[(2S)-2-ethylhexanoyl]-2-nitro-benzamide Openeye Name: N-[(2S)-2-ethylhexanoyl]-2-nitro-benzamide CAS Name: N-[(2S)-2-ethyl-1-oxohexyl]-2-nitrobenzamide IUPAC Name: N-[(2S)-2-ethylhexanoyl]-2-nitrobenzamide Traditional Name: N-[(2S)-2-ethylhexanoyl]-2-nitro-benzamide Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4/c1-3-5-8-11(4-2)14(18)16-15(19)12-9-6-7-10-13(12)17(20)21/h6-7,9-11H,3-5,8H2,1-2H3,(H,16,18,19)/t11-/m0/s1