tert-butyl (2S)-5-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-5-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-benzyl-5-oxo-2H-pyrrole-1-carboxylate CAS Name: (2S)-5-oxo-2-(phenylmethyl)-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-benzyl-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: (2S)-2-benzyl-5-keto-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C=CC1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](C=CC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H19NO3/c1-16(2,3)20-15(19)17-13(9-10-14(17)18)11-12-7-5-4-6-8-12/h4-10,13H,11H2,1-3H3/t13-/m1/s1