N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C21H21ClN4O5 MolecularWeight: 444.86824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O5/c1-12-20(26(28)29)13(2)25(24-12)11-14-5-7-15(8-6-14)21(27)23-17-9-16(22)18(30-3)10-19(17)31-4/h5-10H,11H2,1-4H3,(H,23,27)