(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-chloro-4-isobutoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-chloro-4-isobutoxy-5-methoxy-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OC(C2=CC=CC=C2)C(=O)N)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OC(C2=CC=CC=C2)C(=O)N)OC

InChI

InChI=1S/C20H22ClNO5/c1-12(2)11-26-18-15(21)9-14(10-16(18)25-3)20(24)27-17(19(22)23)13-7-5-4-6-8-13/h4-10,12,17H,11H2,1-3H3,(H2,22,23)