3-chloranyl-4-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-5-methoxy-benzoate

Systemtic Name: 3-chloranyl-4-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-5-methoxy-benzoate Openeye Name: 3-chloro-4-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethoxy]-5-methoxy-benzoate CAS Name: 3-chloro-4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxy-5-methoxybenzoate IUPAC Name: 3-chloro-4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxy-5-methoxybenzoate Traditional Name: 3-chloro-4-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethoxy]-5-methoxy-benzoate Formula: C13H15ClNO5- MolecularWeight: 300.7149

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC1=C(C=C(C=C1Cl)C(=O)[O-])OC

Isomeric SMILES

CCNC(=O)[C@H](C)OC1=C(C=C(C=C1Cl)C(=O)[O-])OC

InChI

InChI=1S/C13H16ClNO5/c1-4-15-12(16)7(2)20-11-9(14)5-8(13(17)18)6-10(11)19-3/h5-7H,4H2,1-3H3,(H,15,16)(H,17,18)/p-1/t7-/m0/s1