N-[2-[3-(diethylamino)-2-oxidanyl-propoxy]-4-nitro-phenyl]-2-methyl-propanamide

Systemtic Name: N-[2-[3-(diethylamino)-2-oxidanyl-propoxy]-4-nitro-phenyl]-2-methyl-propanamide Openeye Name: N-[2-[3-(diethylamino)-2-hydroxy-propoxy]-4-nitro-phenyl]-2-methyl-propanamide CAS Name: N-[2-[3-(diethylamino)-2-hydroxypropoxy]-4-nitrophenyl]-2-methylpropanamide IUPAC Name: N-[2-[3-(diethylamino)-2-hydroxypropoxy]-4-nitrophenyl]-2-methylpropanamide Traditional Name: N-[2-[3-(diethylamino)-2-hydroxy-propoxy]-4-nitro-phenyl]-2-methyl-propionamide Formula: C17H27N3O5 MolecularWeight: 353.41338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O5/c1-5-19(6-2)10-14(21)11-25-16-9-13(20(23)24)7-8-15(16)18-17(22)12(3)4/h7-9,12,14,21H,5-6,10-11H2,1-4H3,(H,18,22)