N-methyl-3-nitro-N-[(1S,2R)-2-oxidanylcyclohexyl]benzamide

Systemtic Name: N-methyl-3-nitro-N-[(1S,2R)-2-oxidanylcyclohexyl]benzamide Openeye Name: N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-3-nitro-benzamide CAS Name: N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-3-nitrobenzamide IUPAC Name: N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-3-nitrobenzamide Traditional Name: N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-3-nitro-benzamide Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1O)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4/c1-15(12-7-2-3-8-13(12)17)14(18)10-5-4-6-11(9-10)16(19)20/h4-6,9,12-13,17H,2-3,7-8H2,1H3/t12-,13+/m0/s1