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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N,N-bis(phenylmethyl)benzamide Openeye Name: N,N-dibenzyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N,N-bis(phenylmethyl)benzamide IUPAC Name: N,N-dibenzyl-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N,N-dibenzyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O3/c1-20-26(31(33)34)21(2)30(28-20)19-24-13-15-25(16-14-24)27(32)29(17-22-9-5-3-6-10-22)18-23-11-7-4-8-12-23/h3-16H,17-19H2,1-2H3