(3-azanyl-3-oxidanylidene-propyl) 3-chloranyl-4,5-dimethoxy-benzoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 3-chloranyl-4,5-dimethoxy-benzoate Openeye Name: (3-amino-3-oxo-propyl) 3-chloro-4,5-dimethoxy-benzoate CAS Name: 3-chloro-4,5-dimethoxybenzoic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 3-chloro-4,5-dimethoxybenzoate Traditional Name: 3-chloro-4,5-dimethoxy-benzoic acid (3-amino-3-keto-propyl) ester Formula: C12H14ClNO5 MolecularWeight: 287.69626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OCCC(=O)N)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OCCC(=O)N)Cl)OC

InChI

InChI=1S/C12H14ClNO5/c1-17-9-6-7(5-8(13)11(9)18-2)12(16)19-4-3-10(14)15/h5-6H,3-4H2,1-2H3,(H2,14,15)