[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 5-chloranyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 5-chloranyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 5-chloro-3-methyl-benzofuran-2-carboxylate CAS Name: 5-chloro-3-methyl-2-benzofurancarboxylic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 5-chloro-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-chloro-3-methyl-coumarilic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H16ClNO4 MolecularWeight: 309.74484

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=C(C2=C(O1)C=CC(=C2)Cl)C

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=C(C2=C(O1)C=CC(=C2)Cl)C

InChI

InChI=1S/C15H16ClNO4/c1-4-17-14(18)9(3)20-15(19)13-8(2)11-7-10(16)5-6-12(11)21-13/h5-7,9H,4H2,1-3H3,(H,17,18)/t9-/m0/s1