[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: [1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [1-methyl-2-oxo-2-(1-phenylethylamino)ethyl] 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid [1-oxo-1-(1-phenylethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylethylamino)propan-2-yl] 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid [2-keto-1-methyl-2-(1-phenylethylamino)ethyl] ester Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C(=O)NC(C)C2=CC=CC=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C(=O)NC(C)C2=CC=CC=C2)OC

InChI

InChI=1S/C21H24ClNO5/c1-5-27-19-17(22)11-16(12-18(19)26-4)21(25)28-14(3)20(24)23-13(2)15-9-7-6-8-10-15/h6-14H,5H2,1-4H3,(H,23,24)