[3-ethyl-5-(4-methoxyphenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [3-ethyl-5-(4-methoxyphenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone Openeye Name: [3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone CAS Name: [3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone IUPAC Name: [3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone Traditional Name: [3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]-(2-nitrophenyl)methanone Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C2=CC=C(C=C2)OC)O)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1=NN(C(C1)(C2=CC=C(C=C2)OC)O)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-3-14-12-19(24,13-8-10-15(27-2)11-9-13)21(20-14)18(23)16-6-4-5-7-17(16)22(25)26/h4-11,24H,3,12H2,1-2H3