O1-tert-butyl O2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl] ester Formula: C19H24ClNO6 MolecularWeight: 397.84996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C19H24ClNO6/c1-19(2,3)27-18(23)21-6-4-5-15(21)17(22)25-10-13-8-14(20)7-12-9-24-11-26-16(12)13/h7-8,15H,4-6,9-11H2,1-3H3/t15-/m0/s1