tert-butyl (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-oxidanylidene-pyrrolidin-3-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-oxidanylidene-pyrrolidin-3-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-oxo-pyrrolidin-3-yl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-oxo-3-pyrrolidinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-oxopyrrolidin-3-yl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(3R,4R)-4-(1H-indol-3-yl)-5-keto-pyrrolidin-3-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2CNC(=O)C2C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]2CNC(=O)[C@H]2C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H27N3O3/c1-21(2,3)27-20(26)24-10-6-9-17(24)15-12-23-19(25)18(15)14-11-22-16-8-5-4-7-13(14)16/h4-5,7-8,11,15,17-18,22H,6,9-10,12H2,1-3H3,(H,23,25)/t15-,17+,18+/m1/s1