N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-homoveratryl-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C15H18N4O5 MolecularWeight: 334.32722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O5/c1-18-14(11(9-17-18)19(21)22)15(20)16-7-6-10-4-5-12(23-2)13(8-10)24-3/h4-5,8-9H,6-7H2,1-3H3,(H,16,20)