3,5-dimethyl-N-[2-[(4-nitrophenyl)amino]ethyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-N-[2-[(4-nitrophenyl)amino]ethyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-N-[2-(4-nitroanilino)ethyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-N-[2-(4-nitroanilino)ethyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-N-[2-(4-nitroanilino)ethyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3,5-dimethyl-N-[2-(4-nitroanilino)ethyl]-1-phenyl-pyrazole-4-carboxamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-14-19(15(2)24(23-14)17-6-4-3-5-7-17)20(26)22-13-12-21-16-8-10-18(11-9-16)25(27)28/h3-11,21H,12-13H2,1-2H3,(H,22,26)