4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(3-phenylmethoxypropyl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(3-phenylmethoxypropyl)benzamide Openeye Name: N-(3-benzyloxypropyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(3-phenylmethoxypropyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(3-phenylmethoxypropyl)benzamide Traditional Name: N-(3-benzoxypropyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCCOCC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCCOCC3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-17-22(27(29)30)18(2)26(25-17)15-19-9-11-21(12-10-19)23(28)24-13-6-14-31-16-20-7-4-3-5-8-20/h3-5,7-12H,6,13-16H2,1-2H3,(H,24,28)