[2-oxidanylidene-2-(phenethylamino)ethyl] 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 3-chloro-4-isobutoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-chloro-4-isobutoxy-5-methoxy-benzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NCCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NCCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H26ClNO5/c1-15(2)13-28-21-18(23)11-17(12-19(21)27-3)22(26)29-14-20(25)24-10-9-16-7-5-4-6-8-16/h4-8,11-12,15H,9-10,13-14H2,1-3H3,(H,24,25)