1-[(3R)-5-(2,4-dimethylfuran-3-yl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3R)-5-(2,4-dimethylfuran-3-yl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3R)-5-(2,4-dimethyl-3-furyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3R)-5-(2,4-dimethyl-3-furanyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3R)-5-(2,4-dimethylfuran-3-yl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5R)-3-(2,4-dimethyl-3-furyl)-5-(3-nitrophenyl)-2-pyrazolin-1-yl]ethanone Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=C1C2=NN(C(C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C)C

Isomeric SMILES

CC1=COC(=C1C2=NN([C@H](C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C)C

InChI

InChI=1S/C17H17N3O4/c1-10-9-24-11(2)17(10)15-8-16(19(18-15)12(3)21)13-5-4-6-14(7-13)20(22)23/h4-7,9,16H,8H2,1-3H3/t16-/m1/s1