N-[(2S)-5-methylhexan-2-yl]-2-nitro-benzamide

Systemtic Name: N-[(2S)-5-methylhexan-2-yl]-2-nitro-benzamide Openeye Name: N-[(1S)-1,4-dimethylpentyl]-2-nitro-benzamide CAS Name: N-[(2S)-5-methylhexan-2-yl]-2-nitrobenzamide IUPAC Name: N-[(2S)-5-methylhexan-2-yl]-2-nitrobenzamide Traditional Name: N-[(1S)-1,4-dimethylpentyl]-2-nitro-benzamide Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3/c1-10(2)8-9-11(3)15-14(17)12-6-4-5-7-13(12)16(18)19/h4-7,10-11H,8-9H2,1-3H3,(H,15,17)/t11-/m0/s1