(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl (3S)-1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-furanylmethyl)-5-oxo-3-pyrrolidinecarboxylic acid (2-ethoxycarbonyl-3-benzofuranyl)methyl ester IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-furfuryl)-5-keto-pyrrolidine-3-carboxylic acid (2-carbethoxybenzofuran-3-yl)methyl ester Formula: C22H21NO7 MolecularWeight: 411.40464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3CC(=O)N(C3)CC4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)[C@H]3CC(=O)N(C3)CC4=CC=CO4

InChI

InChI=1S/C22H21NO7/c1-2-27-22(26)20-17(16-7-3-4-8-18(16)30-20)13-29-21(25)14-10-19(24)23(11-14)12-15-6-5-9-28-15/h3-9,14H,2,10-13H2,1H3/t14-/m0/s1