2-(3-methyl-4-nitro-phenoxy)-N-pentan-3-yl-ethanamide

Systemtic Name: 2-(3-methyl-4-nitro-phenoxy)-N-pentan-3-yl-ethanamide Openeye Name: N-(1-ethylpropyl)-2-(3-methyl-4-nitro-phenoxy)acetamide CAS Name: 2-(3-methyl-4-nitrophenoxy)-N-pentan-3-ylacetamide IUPAC Name: 2-(3-methyl-4-nitrophenoxy)-N-pentan-3-ylacetamide Traditional Name: N-(1-ethylpropyl)-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC1=CC(=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCC(CC)NC(=O)COC1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N2O4/c1-4-11(5-2)15-14(17)9-20-12-6-7-13(16(18)19)10(3)8-12/h6-8,11H,4-5,9H2,1-3H3,(H,15,17)