N-[(2-chloranyl-5-nitro-phenyl)methyl]-N,3,5-trimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N,3,5-trimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N,3,5-trimethyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N,3,5-trimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N,3,5-trimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N,3,5-trimethyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C22H23ClN4O3/c1-14-5-7-17(8-6-14)12-26-16(3)21(15(2)24-26)22(28)25(4)13-18-11-19(27(29)30)9-10-20(18)23/h5-11H,12-13H2,1-4H3