N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitro-benzamide

Systemtic Name: N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitro-benzamide Openeye Name: N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitro-benzamide CAS Name: N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitrobenzamide IUPAC Name: N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitrobenzamide Traditional Name: N-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4-nitro-benzamide Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O3/c1-11-5-3-4-6-14(11)16(2)15(18)12-7-9-13(10-8-12)17(19)20/h7-11,14H,3-6H2,1-2H3/t11-,14-/m0/s1