tert-butyl (2R)-1-[3-(5-methoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)pyridin-2-yl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2R)-1-[3-(5-methoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)pyridin-2-yl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2R)-1-[3-(5-methoxy-4-oxo-3,1-benzoxazin-2-yl)-2-pyridyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[3-(5-methoxy-4-oxo-3,1-benzoxazin-2-yl)-2-pyridinyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-1-[3-(5-methoxy-4-oxo-3,1-benzoxazin-2-yl)pyridin-2-yl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[3-(4-keto-5-methoxy-3,1-benzoxazin-2-yl)-2-pyridyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1C2=C(C=CC=N2)C3=NC4=C(C(=CC=C4)OC)C(=O)O3

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1CCCN1C2=C(C=CC=N2)C3=NC4=C(C(=CC=C4)OC)C(=O)O3

InChI

InChI=1S/C23H25N3O5/c1-23(2,3)31-21(27)16-10-7-13-26(16)19-14(8-6-12-24-19)20-25-15-9-5-11-17(29-4)18(15)22(28)30-20/h5-6,8-9,11-12,16H,7,10,13H2,1-4H3/t16-/m1/s1