[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,5-bis(chloranyl)-4-methoxy-benzoate

Systemtic Name: [(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,5-bis(chloranyl)-4-methoxy-benzoate Openeye Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3,5-dichloro-4-methoxy-benzoate CAS Name: 3,5-dichloro-4-methoxybenzoic acid [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3,5-dichloro-4-methoxybenzoate Traditional Name: 3,5-dichloro-4-methoxy-benzoic acid [(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C19H17Cl2NO4 MolecularWeight: 394.24858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)NC3CC3)Cl

InChI

InChI=1S/C19H17Cl2NO4/c1-25-17-14(20)9-12(10-15(17)21)19(24)26-16(11-5-3-2-4-6-11)18(23)22-13-7-8-13/h2-6,9-10,13,16H,7-8H2,1H3,(H,22,23)/t16-/m0/s1