[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)ethanoate Openeye Name: [(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-(6-ethylbenzofuran-3-yl)acetate CAS Name: 2-(6-ethyl-3-benzofuranyl)acetic acid [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-ethylbenzofuran-3-yl)acetic acid [(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)OC(C)C(=O)NC3CC3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)O[C@@H](C)C(=O)NC3CC3

InChI

InChI=1S/C18H21NO4/c1-3-12-4-7-15-13(10-22-16(15)8-12)9-17(20)23-11(2)18(21)19-14-5-6-14/h4,7-8,10-11,14H,3,5-6,9H2,1-2H3,(H,19,21)/t11-/m0/s1