2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[4-(difluoromethoxy)-3-methoxy-benzyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H12F2N2O6 MolecularWeight: 378.283786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C17H12F2N2O6/c1-26-13-7-9(5-6-12(13)27-17(18)19)8-20-15(22)10-3-2-4-11(21(24)25)14(10)16(20)23/h2-7,17H,8H2,1H3