methyl 2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate Openeye Name: methyl 2-[[5-(4-nitrophenyl)-2-furyl]methylene]-3-oxo-butanoate CAS Name: 2-[[5-(4-nitrophenyl)-2-furanyl]methylidene]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate Traditional Name: 2-acetyl-3-[5-(4-nitrophenyl)-2-furyl]acrylic acid methyl ester Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H13NO6/c1-10(18)14(16(19)22-2)9-13-7-8-15(23-13)11-3-5-12(6-4-11)17(20)21/h3-9H,1-2H3