tert-butyl 2-aminocarbonyl-4-[4-[3-(5-cyano-1-benzofuran-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-aminocarbonyl-4-[4-[3-(5-cyano-1-benzofuran-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-carbamoyl-4-[4-[1-[(5-cyanobenzofuran-2-yl)methyl]-2-ethoxy-2-oxo-ethyl]phenoxy]pyrrolidine-1-carboxylate CAS Name: 2-carbamoyl-4-[4-[3-(5-cyano-2-benzofuranyl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-carbamoyl-4-[4-[3-(5-cyano-1-benzofuran-2-yl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]pyrrolidine-1-carboxylate Traditional Name: 2-carbamoyl-4-[4-[1-[(5-cyanobenzofuran-2-yl)methyl]-2-ethoxy-2-keto-ethyl]phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H33N3O7 MolecularWeight: 547.59892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(O1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CC(N(C4)C(=O)OC(C)(C)C)C(=O)N

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(O1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CC(N(C4)C(=O)OC(C)(C)C)C(=O)N

InChI

InChI=1S/C30H33N3O7/c1-5-37-28(35)24(14-22-13-20-12-18(16-31)6-11-26(20)39-22)19-7-9-21(10-8-19)38-23-15-25(27(32)34)33(17-23)29(36)40-30(2,3)4/h6-13,23-25H,5,14-15,17H2,1-4H3,(H2,32,34)