O1-tert-butyl O2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-(6-chloro-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-(6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: 1-O-tert-butyl 2-O-(6-chloro-2-oxo-4-propylchromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(6-chloro-2-keto-4-propyl-chromen-7-yl) ester Formula: C22H26ClNO6 MolecularWeight: 435.89794

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C3CCCN3C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C

InChI

InChI=1S/C22H26ClNO6/c1-5-7-13-10-19(25)28-17-12-18(15(23)11-14(13)17)29-20(26)16-8-6-9-24(16)21(27)30-22(2,3)4/h10-12,16H,5-9H2,1-4H3/t16-/m0/s1