O1-tert-butyl O2-ethyl (2S)-7-chloranyl-2,3-dihydroindole-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl (2S)-7-chloranyl-2,3-dihydroindole-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl (2S)-7-chloroindoline-1,2-dicarboxylate CAS Name: (2S)-7-chloro-2,3-dihydroindole-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl (2S)-7-chloro-2,3-dihydroindole-1,2-dicarboxylate Traditional Name: (2S)-7-chloroindoline-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=C(N1C(=O)OC(C)(C)C)C(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1CC2=C(N1C(=O)OC(C)(C)C)C(=CC=C2)Cl

InChI

InChI=1S/C16H20ClNO4/c1-5-21-14(19)12-9-10-7-6-8-11(17)13(10)18(12)15(20)22-16(2,3)4/h6-8,12H,5,9H2,1-4H3/t12-/m0/s1