N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenyl-pyrazole-4-carboxamide CAS Name: N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenylpyrazole-4-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-1-(4-nitrophenyl)-5-phenyl-pyrazole-4-carboxamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CN(C)CCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

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