ethyl (2Z)-2-[[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2Z)-2-[[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2Z)-2-[[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]methylene]-3-oxo-butanoate CAS Name: (2Z)-2-[[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-[2-(4-chlorobenzyl)oxy-5-nitro-phenyl]acrylic acid ethyl ester Formula: C20H18ClNO6 MolecularWeight: 403.81302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=C(C=C2)Cl)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C\C1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=C(C=C2)Cl)/C(=O)C

InChI

InChI=1S/C20H18ClNO6/c1-3-27-20(24)18(13(2)23)11-15-10-17(22(25)26)8-9-19(15)28-12-14-4-6-16(21)7-5-14/h4-11H,3,12H2,1-2H3/b18-11-