O1-tert-butyl O2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-(6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: 1-O-tert-butyl 2-O-(6-chloro-3,4-dimethyl-2-oxochromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(6-chloro-2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C21H24ClNO6 MolecularWeight: 421.87136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C3CCCN3C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H24ClNO6/c1-11-12(2)18(24)27-16-10-17(14(22)9-13(11)16)28-19(25)15-7-6-8-23(15)20(26)29-21(3,4)5/h9-10,15H,6-8H2,1-5H3/t15-/m0/s1