(2,6-dimethoxyphenyl) 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-benzoate

Systemtic Name: (2,6-dimethoxyphenyl) 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-benzoate Openeye Name: (2,6-dimethoxyphenyl) 4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-benzoate CAS Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoic acid (2,6-dimethoxyphenyl) ester IUPAC Name: (2,6-dimethoxyphenyl) 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzoic acid (2,6-dimethoxyphenyl) ester Formula: C18H18ClNO7 MolecularWeight: 395.79102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OC(=O)C2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OC(=O)C2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

InChI

InChI=1S/C18H18ClNO7/c1-23-12-5-4-6-13(24-2)17(12)27-18(22)10-7-11(19)16(14(8-10)25-3)26-9-15(20)21/h4-8H,9H2,1-3H3,(H2,20,21)