[2-[1-(1-benzofuran-2-yl)ethylamino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-[1-(1-benzofuran-2-yl)ethylamino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-[1-(benzofuran-2-yl)ethylamino]-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-[1-(2-benzofuranyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(1-benzofuran-2-yl)ethylamino]-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-[1-(benzofuran-2-yl)ethylamino]-2-keto-ethyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)COC(=O)C(C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(C)C1=CC2=CC=CC=C2O1)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-14(19-12-17-10-6-7-11-18(17)29-19)23-20(25)13-28-22(27)15(2)24-21(26)16-8-4-3-5-9-16/h3-12,14-15H,13H2,1-2H3,(H,23,25)(H,24,26)/t14?,15-/m0/s1