N-[3-[ethyl(phenyl)amino]propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[3-(N-ethylanilino)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[3-(N-ethylanilino)propyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[3-(N-ethylanilino)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O3/c1-2-24(17-8-4-3-5-9-17)14-7-13-22-21(27)20-12-15-25(23-20)18-10-6-11-19(16-18)26(28)29/h3-6,8-12,15-16H,2,7,13-14H2,1H3,(H,22,27)