methyl 4-(2-azanyl-3-methoxy-3-oxidanylidene-propyl)-2-fluoranyl-benzoate

Systemtic Name: methyl 4-(2-azanyl-3-methoxy-3-oxidanylidene-propyl)-2-fluoranyl-benzoate Openeye Name: methyl 4-(2-amino-3-methoxy-3-oxo-propyl)-2-fluoro-benzoate CAS Name: 4-(2-amino-3-methoxy-3-oxopropyl)-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 4-(2-amino-3-methoxy-3-oxopropyl)-2-fluorobenzoate Traditional Name: 4-(2-amino-3-keto-3-methoxy-propyl)-2-fluoro-benzoic acid methyl ester Formula: C12H14FNO4 MolecularWeight: 255.242263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)CC(C(=O)OC)N)F

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)CC(C(=O)OC)N)F

InChI

InChI=1S/C12H14FNO4/c1-17-11(15)8-4-3-7(5-9(8)13)6-10(14)12(16)18-2/h3-5,10H,6,14H2,1-2H3