2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]propanamide

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]propanamide CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]propanamide Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]propionamide Formula: C21H21ClN4O5 MolecularWeight: 444.86824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-])C)Cl

InChI

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