1-[3-(3-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[3-(3-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[3-(3-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[3-(3-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[3-(3-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[5-(3-nitrophenyl)-3-phenyl-3-pyrazolin-1-yl]propan-1-one Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C=C(N1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1C(C=C(N1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-2-18(22)20-17(14-9-6-10-15(11-14)21(23)24)12-16(19-20)13-7-4-3-5-8-13/h3-12,17,19H,2H2,1H3