1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone

Systemtic Name: 1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone Openeye Name: 1-[(3S)-3,5-bis(2-furyl)-3,4-dihydropyrazol-2-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone CAS Name: 1-[(3S)-3,5-bis(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-(4-methoxy-2-nitrophenoxy)ethanone IUPAC Name: 1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-methoxy-2-nitrophenoxy)ethanone Traditional Name: 1-[(5S)-3,5-bis(2-furyl)-2-pyrazolin-1-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(=O)N2[C@@H](CC(=N2)C3=CC=CO3)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O7/c1-27-13-6-7-19(16(10-13)23(25)26)30-12-20(24)22-15(18-5-3-9-29-18)11-14(21-22)17-4-2-8-28-17/h2-10,15H,11-12H2,1H3/t15-/m0/s1