N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-homoveratryl-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H22N4O5/c1-12(10-20-11-14(9-19-20)21(23)24)17(22)18-7-6-13-4-5-15(25-2)16(8-13)26-3/h4-5,8-9,11-12H,6-7,10H2,1-3H3,(H,18,22)