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

Systemtic Name: N-butyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-phenyl-benzamide Openeye Name: N-butyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-phenyl-benzamide CAS Name: N-butyl-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-phenylbenzamide IUPAC Name: N-butyl-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-phenylbenzamide Traditional Name: N-butyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-phenyl-benzamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C23H26N4O3/c1-4-5-15-25(21-9-7-6-8-10-21)23(28)20-13-11-19(12-14-20)16-26-18(3)22(27(29)30)17(2)24-26/h6-14H,4-5,15-16H2,1-3H3