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

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C26H30FNO2 MolecularWeight: 407.520303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C)C)C(C)(C)C

InChI

InChI=1S/C26H30FNO2/c1-16-12-20(26(5,6)7)13-17(2)24(16)15-30-25(29)23-14-18(3)28(19(23)4)22-10-8-21(27)9-11-22/h8-14H,15H2,1-7H3