methyl 4-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]oxymethyl]benzoate CAS Name: 4-[[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxymethyl]benzoate Traditional Name: 4-[[(E)-3-(5-nitro-2-furyl)acryloyl]oxymethyl]benzoic acid methyl ester Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7/c1-22-16(19)12-4-2-11(3-5-12)10-23-15(18)9-7-13-6-8-14(24-13)17(20)21/h2-9H,10H2,1H3/b9-7+