tert-butyl (2S,3R)-5-methyl-3-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl (2S,3R)-5-methyl-3-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylate Openeye Name: tert-butyl (2S,3R)-5-methyl-3-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylate CAS Name: (2S,3R)-5-methyl-3-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-5-methyl-3-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylate Traditional Name: (2S,3R)-5-methyl-3-phenyl-1-pyrroline-2-carboxylic acid tert-butyl ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(C1)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=N[C@@H]([C@H](C1)C2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H21NO2/c1-11-10-13(12-8-6-5-7-9-12)14(17-11)15(18)19-16(2,3)4/h5-9,13-14H,10H2,1-4H3/t13-,14+/m1/s1