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

Systemtic Name: [(2S)-1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)ethanoate Openeye Name: [(1S)-2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] 2-(6-ethylbenzofuran-3-yl)acetate CAS Name: 2-(6-ethyl-3-benzofuranyl)acetic acid [(2S)-1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-ethylbenzofuran-3-yl)acetic acid [(1S)-2-[(2-chloro-3-pyridyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)OC(C)C(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)O[C@@H](C)C(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H19ClN2O4/c1-3-13-6-7-15-14(11-26-17(15)9-13)10-18(24)27-12(2)20(25)23-16-5-4-8-22-19(16)21/h4-9,11-12H,3,10H2,1-2H3,(H,23,25)/t12-/m0/s1