N-[(3,4-dimethoxyphenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide Traditional Name: 4-(4-nitropyrazol-1-yl)-N-veratryl-butyramide Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H20N4O5/c1-24-14-6-5-12(8-15(14)25-2)9-17-16(21)4-3-7-19-11-13(10-18-19)20(22)23/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,17,21)