(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C27H33NO2 MolecularWeight: 403.55642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OCC3=C(C=C(C=C3C)C(C)(C)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OCC3=C(C=C(C=C3C)C(C)(C)C)C)C

InChI

InChI=1S/C27H33NO2/c1-17-9-11-23(12-10-17)28-20(4)15-24(21(28)5)26(29)30-16-25-18(2)13-22(14-19(25)3)27(6,7)8/h9-15H,16H2,1-8H3