tert-butyl (2S)-2-[(2S)-butan-2-yl]-3-oxidanylidene-5-phenyl-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(2S)-butan-2-yl]-3-oxidanylidene-5-phenyl-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(1S)-1-methylpropyl]-3-oxo-5-phenyl-2H-pyrrole-1-carboxylate CAS Name: (2S)-2-[(2S)-butan-2-yl]-3-oxo-5-phenyl-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(2S)-butan-2-yl]-3-oxo-5-phenyl-2H-pyrrole-1-carboxylate Traditional Name: (2S)-3-keto-2-[(1S)-1-methylpropyl]-5-phenyl-2-pyrroline-1-carboxylic acid tert-butyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)C=C(N1C(=O)OC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO3/c1-6-13(2)17-16(21)12-15(14-10-8-7-9-11-14)20(17)18(22)23-19(3,4)5/h7-13,17H,6H2,1-5H3/t13-,17-/m0/s1