2-methoxyethyl (2E)-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl (2E)-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl (2E)-2-[[5-(3-nitrophenyl)-2-furyl]methylene]-3-oxo-butanoate CAS Name: (2E)-2-[[5-(3-nitrophenyl)-2-furanyl]methylidene]-3-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (2E)-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-[5-(3-nitrophenyl)-2-furyl]acrylic acid 2-methoxyethyl ester Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)/C(=C\C1=CC=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)OCCOC

InChI

InChI=1S/C18H17NO7/c1-12(20)16(18(21)25-9-8-24-2)11-15-6-7-17(26-15)13-4-3-5-14(10-13)19(22)23/h3-7,10-11H,8-9H2,1-2H3/b16-11+