N-[2-(diethylamino)-2-phenyl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[2-(diethylamino)-2-phenylethyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[2-(diethylamino)-2-phenylethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=NN(C=C1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=NN(C=C1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O3/c1-3-25(4-2)21(17-9-6-5-7-10-17)16-23-22(28)20-13-14-26(24-20)18-11-8-12-19(15-18)27(29)30/h5-15,21H,3-4,16H2,1-2H3,(H,23,28)