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

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]benzamide Openeye Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]benzamide CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]benzamide IUPAC Name: 4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]benzamide Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]benzamide Formula: C22H23ClN4O5 MolecularWeight: 458.89482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C)Cl

InChI

InChI=1S/C22H23ClN4O5/c1-13-21(23)14(2)26(25-13)17-7-5-15(6-8-17)22(28)24-10-9-16-11-19(31-3)20(32-4)12-18(16)27(29)30/h5-8,11-12H,9-10H2,1-4H3,(H,24,28)