tert-butyl 2-[3-(4-methylphenyl)-3-oxidanyl-propyl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-[3-(4-methylphenyl)-3-oxidanyl-propyl]pyrrole-1-carboxylate Openeye Name: tert-butyl 2-[3-hydroxy-3-(p-tolyl)propyl]pyrrole-1-carboxylate CAS Name: 2-[3-hydroxy-3-(4-methylphenyl)propyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-hydroxy-3-(4-methylphenyl)propyl]pyrrole-1-carboxylate Traditional Name: 2-[3-hydroxy-3-(p-tolyl)propyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCC2=CC=CN2C(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C(CCC2=CC=CN2C(=O)OC(C)(C)C)O

InChI

InChI=1S/C19H25NO3/c1-14-7-9-15(10-8-14)17(21)12-11-16-6-5-13-20(16)18(22)23-19(2,3)4/h5-10,13,17,21H,11-12H2,1-4H3