O1-tert-butyl O2-(2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-(2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-(2-oxo-4-propyl-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: 1-O-tert-butyl 2-O-(2-oxo-4-propylchromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(2-keto-4-propyl-chromen-7-yl) ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCCN3C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C

InChI

InChI=1S/C22H27NO6/c1-5-7-14-12-19(24)28-18-13-15(9-10-16(14)18)27-20(25)17-8-6-11-23(17)21(26)29-22(2,3)4/h9-10,12-13,17H,5-8,11H2,1-4H3/t17-/m0/s1