[3-(5-bromanyl-2-oxidanyl-phenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-(1-ethyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: [3-(5-bromanyl-2-oxidanyl-phenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-(1-ethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: [3-(5-bromo-2-hydroxy-phenyl)-5-(2-naphthyl)-3,4-dihydropyrazol-2-yl]-(1-ethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: [3-(5-bromo-2-hydroxyphenyl)-5-(2-naphthalenyl)-3,4-dihydropyrazol-2-yl]-(1-ethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: [3-(5-bromo-2-hydroxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-(1-ethyl-4-nitropyrazol-3-yl)methanone Traditional Name: [5-(5-bromo-2-hydroxy-phenyl)-3-(2-naphthyl)-2-pyrazolin-1-yl]-(1-ethyl-4-nitro-pyrazol-3-yl)methanone Formula: C25H20BrN5O4 MolecularWeight: 534.3614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=C(C=CC(=C5)Br)O)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=C(C=CC(=C5)Br)O)[N+](=O)[O-]

InChI

InChI=1S/C25H20BrN5O4/c1-2-29-14-22(31(34)35)24(28-29)25(33)30-21(19-12-18(26)9-10-23(19)32)13-20(27-30)17-8-7-15-5-3-4-6-16(15)11-17/h3-12,14,21,32H,2,13H2,1H3