N-[(3,5-dimethoxyphenyl)methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(3,5-dimethoxybenzyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NCC2=CC(=CC(=C2)OC)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NCC2=CC(=CC(=C2)OC)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O5/c1-10-16(21(23)24)11(2)20(19-10)12(3)17(22)18-9-13-6-14(25-4)8-15(7-13)26-5/h6-8,12H,9H2,1-5H3,(H,18,22)