tert-butyl 3-[4-[3-(5-cyano-7-methoxy-1-benzofuran-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[4-[3-(5-cyano-7-methoxy-1-benzofuran-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[4-[1-[(5-cyano-7-methoxy-benzofuran-2-yl)methyl]-2-ethoxy-2-oxo-ethyl]phenoxy]pyrrolidine-1-carboxylate CAS Name: 3-[4-[3-(5-cyano-7-methoxy-2-benzofuranyl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[3-(5-cyano-7-methoxy-1-benzofuran-2-yl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]pyrrolidine-1-carboxylate Traditional Name: 3-[4-[1-[(5-cyano-7-methoxy-benzofuran-2-yl)methyl]-2-ethoxy-2-keto-ethyl]phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H34N2O7 MolecularWeight: 534.60016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(O1)C(=CC(=C2)C#N)OC)C3=CC=C(C=C3)OC4CCN(C4)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(O1)C(=CC(=C2)C#N)OC)C3=CC=C(C=C3)OC4CCN(C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H34N2O7/c1-6-36-28(33)25(16-24-15-21-13-19(17-31)14-26(35-5)27(21)38-24)20-7-9-22(10-8-20)37-23-11-12-32(18-23)29(34)39-30(2,3)4/h7-10,13-15,23,25H,6,11-12,16,18H2,1-5H3