(2-azanyl-2-oxidanylidene-ethyl) 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C15H20ClNO5 MolecularWeight: 329.776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N)OCC

InChI

InChI=1S/C15H20ClNO5/c1-3-5-6-21-14-11(16)7-10(8-12(14)20-4-2)15(19)22-9-13(17)18/h7-8H,3-6,9H2,1-2H3,(H2,17,18)