[2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 3-ethoxy-4-methoxy-benzoate

Systemtic Name: [2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 3-ethoxy-4-methoxy-benzoate Openeye Name: [2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxo-ethyl] 3-ethoxy-4-methoxy-benzoate CAS Name: 3-ethoxy-4-methoxybenzoic acid [2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl] 3-ethoxy-4-methoxybenzoate Traditional Name: 3-ethoxy-4-methoxy-benzoic acid [2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NC(C)C2=CC=CC=C2Cl)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)N[C@@H](C)C2=CC=CC=C2Cl)OC

InChI

InChI=1S/C20H22ClNO5/c1-4-26-18-11-14(9-10-17(18)25-3)20(24)27-12-19(23)22-13(2)15-7-5-6-8-16(15)21/h5-11,13H,4,12H2,1-3H3,(H,22,23)/t13-/m0/s1