tert-butyl 3-methyl-5-oxidanylidene-4-phenyl-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-methyl-5-oxidanylidene-4-phenyl-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl 3-methyl-5-oxo-4-phenyl-2H-pyrrole-1-carboxylate CAS Name: 3-methyl-5-oxo-4-phenyl-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-methyl-5-oxo-4-phenyl-2H-pyrrole-1-carboxylate Traditional Name: 2-keto-4-methyl-3-phenyl-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO3/c1-11-10-17(15(19)20-16(2,3)4)14(18)13(11)12-8-6-5-7-9-12/h5-9H,10H2,1-4H3