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

Systemtic Name: O1-tert-butyl O2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[(7-methyl-2-oxo-chromen-4-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[(7-methyl-2-oxochromen-4-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(2-keto-7-methyl-chromen-4-yl)methyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCN3C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C

InChI

InChI=1S/C21H25NO6/c1-13-7-8-15-14(11-18(23)27-17(15)10-13)12-26-19(24)16-6-5-9-22(16)20(25)28-21(2,3)4/h7-8,10-11,16H,5-6,9,12H2,1-4H3/t16-/m0/s1