1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenyl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenyl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenyl-pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenyl-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-3-(4-nitrophenyl)-N,N-diphenyl-pyrazole-4-carboxamide Formula: C25H19N5O3 MolecularWeight: 437.45006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])CCC#N

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])CCC#N

InChI

InChI=1S/C25H19N5O3/c26-16-7-17-28-18-23(24(27-28)19-12-14-22(15-13-19)30(32)33)25(31)29(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-15,18H,7,17H2