N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-isopropyl-4-nitro-isoxazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-homoveratryl-5-isopropyl-4-nitro-isoxazole-3-carboxamide Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NO1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NO1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-10(2)16-15(20(22)23)14(19-26-16)17(21)18-8-7-11-5-6-12(24-3)13(9-11)25-4/h5-6,9-10H,7-8H2,1-4H3,(H,18,21)