[(2Z)-2-[(cyclopropylamino)methylidene]butanoyl] 4-chloranyl-5-fluoranyl-2-nitro-benzoate

Systemtic Name: [(2Z)-2-[(cyclopropylamino)methylidene]butanoyl] 4-chloranyl-5-fluoranyl-2-nitro-benzoate Openeye Name: [(2Z)-2-[(cyclopropylamino)methylene]butanoyl] 4-chloro-5-fluoro-2-nitro-benzoate CAS Name: 4-chloro-5-fluoro-2-nitrobenzoic acid [(2Z)-2-[(cyclopropylamino)methylidene]-1-oxobutyl] ester IUPAC Name: [(2Z)-2-[(cyclopropylamino)methylidene]butanoyl] 4-chloro-5-fluoro-2-nitrobenzoate Traditional Name: 4-chloro-5-fluoro-2-nitro-benzoic acid [(Z)-3-(cyclopropylamino)-2-ethyl-acryloyl] ester Formula: C15H14ClFN2O5 MolecularWeight: 356.733463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CNC1CC1)C(=O)OC(=O)C2=CC(=C(C=C2[N+](=O)[O-])Cl)F

Isomeric SMILES

CC/C(=C/NC1CC1)/C(=O)OC(=O)C2=CC(=C(C=C2[N+](=O)[O-])Cl)F

InChI

InChI=1S/C15H14ClFN2O5/c1-2-8(7-18-9-3-4-9)14(20)24-15(21)10-5-12(17)11(16)6-13(10)19(22)23/h5-7,9,18H,2-4H2,1H3/b8-7-