2-(3-nitrophenoxy)-N-[[4-(2-oxidanylpropan-2-yl)cyclohexyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-(3-nitrophenoxy)-N-[[4-(2-oxidanylpropan-2-yl)cyclohexyl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-(1-hydroxy-1-methyl-ethyl)cyclohexyl]methyl]-2-(3-nitrophenoxy)pyridine-3-carboxamide CAS Name: N-[[4-(2-hydroxypropan-2-yl)cyclohexyl]methyl]-2-(3-nitrophenoxy)-3-pyridinecarboxamide IUPAC Name: N-[[4-(2-hydroxypropan-2-yl)cyclohexyl]methyl]-2-(3-nitrophenoxy)pyridine-3-carboxamide Traditional Name: N-[[4-(1-hydroxy-1-methyl-ethyl)cyclohexyl]methyl]-2-(3-nitrophenoxy)nicotinamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCC(CC1)CNC(=O)C2=C(N=CC=C2)OC3=CC=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C1CCC(CC1)CNC(=O)C2=C(N=CC=C2)OC3=CC=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C22H27N3O5/c1-22(2,27)16-10-8-15(9-11-16)14-24-20(26)19-7-4-12-23-21(19)30-18-6-3-5-17(13-18)25(28)29/h3-7,12-13,15-16,27H,8-11,14H2,1-2H3,(H,24,26)