[3-(phenylmethyl)-1H-pyrrol-2-yl]methyl 3-(4-tert-butylphenoxy)-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: [3-(phenylmethyl)-1H-pyrrol-2-yl]methyl 3-(4-tert-butylphenoxy)-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: (3-benzyl-1H-pyrrol-2-yl)methyl 3-(4-tert-butylphenoxy)-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 3-(4-tert-butylphenoxy)-2,2-dimethyl-1-cyclopropanecarboxylic acid [3-(phenylmethyl)-1H-pyrrol-2-yl]methyl ester IUPAC Name: (3-benzyl-1H-pyrrol-2-yl)methyl 3-(4-tert-butylphenoxy)-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 3-(4-tert-butylphenoxy)-2,2-dimethyl-cyclopropanecarboxylic acid (3-benzyl-1H-pyrrol-2-yl)methyl ester Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1OC2=CC=C(C=C2)C(C)(C)C)C(=O)OCC3=C(C=CN3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(C1OC2=CC=C(C=C2)C(C)(C)C)C(=O)OCC3=C(C=CN3)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H33NO3/c1-27(2,3)21-11-13-22(14-12-21)32-25-24(28(25,4)5)26(30)31-18-23-20(15-16-29-23)17-19-9-7-6-8-10-19/h6-16,24-25,29H,17-18H2,1-5H3