tert-butyl 3,5-dimethyl-2-(phenylmethyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3,5-dimethyl-2-(phenylmethyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 2-benzyl-3,5-dimethyl-pyrrole-1-carboxylate CAS Name: 3,5-dimethyl-2-(phenylmethyl)-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-3,5-dimethylpyrrole-1-carboxylate Traditional Name: 2-benzyl-3,5-dimethyl-pyrrole-1-carboxylic acid tert-butyl ester Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO2/c1-13-11-14(2)19(17(20)21-18(3,4)5)16(13)12-15-9-7-6-8-10-15/h6-11H,12H2,1-5H3