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

Systemtic Name: 2-methoxyethyl (2E)-2-[(4-chloranyl-3-nitro-phenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl (2E)-2-[(4-chloro-3-nitro-phenyl)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(4-chloro-3-nitrophenyl)methylidene]-3-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (2E)-2-[(4-chloro-3-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(4-chloro-3-nitro-phenyl)acrylic acid 2-methoxyethyl ester Formula: C14H14ClNO6 MolecularWeight: 327.71706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C=C1)Cl)[N+](=O)[O-])C(=O)OCCOC

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClNO6/c1-9(17)11(14(18)22-6-5-21-2)7-10-3-4-12(15)13(8-10)16(19)20/h3-4,7-8H,5-6H2,1-2H3/b11-7+