(3,3-dimethyl-2-oxidanylidene-butyl) 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2,5-dimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C19H23NO3/c1-13-11-16(18(22)23-12-17(21)19(3,4)5)14(2)20(13)15-9-7-6-8-10-15/h6-11H,12H2,1-5H3