[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]methyl (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]methyl (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]methyl (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]methyl ester IUPAC Name: [4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]methyl (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [4-(difluoromethoxy)-5-methoxy-2-nitro-benzyl] ester Formula: C16H13F2NO6S MolecularWeight: 385.339326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C=CC2=CC=CS2)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)/C=C/C2=CC=CS2)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C16H13F2NO6S/c1-23-13-7-10(12(19(21)22)8-14(13)25-16(17)18)9-24-15(20)5-4-11-3-2-6-26-11/h2-8,16H,9H2,1H3/b5-4+