N-[4-(5-nitro-2-oxidanyl-phenoxy)butyl]prop-2-enamide

Systemtic Name: N-[4-(5-nitro-2-oxidanyl-phenoxy)butyl]prop-2-enamide Openeye Name: N-[4-(2-hydroxy-5-nitro-phenoxy)butyl]prop-2-enamide CAS Name: N-[4-(2-hydroxy-5-nitrophenoxy)butyl]-2-propenamide IUPAC Name: N-[4-(2-hydroxy-5-nitrophenoxy)butyl]prop-2-enamide Traditional Name: N-[4-(2-hydroxy-5-nitro-phenoxy)butyl]acrylamide Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=C(C=CC(=C1)[N+](=O)[O-])O

Isomeric SMILES

C=CC(=O)NCCCCOC1=C(C=CC(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C13H16N2O5/c1-2-13(17)14-7-3-4-8-20-12-9-10(15(18)19)5-6-11(12)16/h2,5-6,9,16H,1,3-4,7-8H2,(H,14,17)