(3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C16H11N3O6 MolecularWeight: 341.27504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O6/c20-15(9-7-12-6-8-14(24-12)19(21)22)23-10-13-17-16(18-25-13)11-4-2-1-3-5-11/h1-9H,10H2/b9-7+