2-methoxyethyl (2E)-2-[[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl (2E)-2-[[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]methylidene]-3-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl (2E)-2-[[5-(4-chloro-2-nitro-phenyl)-2-furyl]methylene]-3-oxo-butanoate CAS Name: (2E)-2-[[5-(4-chloro-2-nitrophenyl)-2-furanyl]methylidene]-3-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (2E)-2-[[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]acrylic acid 2-methoxyethyl ester Formula: C18H16ClNO7 MolecularWeight: 393.77514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClNO7/c1-11(21)15(18(22)26-8-7-25-2)10-13-4-6-17(27-13)14-5-3-12(19)9-16(14)20(23)24/h3-6,9-10H,7-8H2,1-2H3/b15-10+