methyl 5-tert-butyl-1-(2-methylpropyl)-2-phenyl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-tert-butyl-1-(2-methylpropyl)-2-phenyl-pyrrole-3-carboxylate Openeye Name: methyl 5-tert-butyl-1-isobutyl-2-phenyl-pyrrole-3-carboxylate CAS Name: 5-tert-butyl-1-(2-methylpropyl)-2-phenyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-1-(2-methylpropyl)-2-phenylpyrrole-3-carboxylate Traditional Name: 5-tert-butyl-1-isobutyl-2-phenyl-pyrrole-3-carboxylic acid methyl ester Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC(=C1C2=CC=CC=C2)C(=O)OC)C(C)(C)C

Isomeric SMILES

CC(C)CN1C(=CC(=C1C2=CC=CC=C2)C(=O)OC)C(C)(C)C

InChI

InChI=1S/C20H27NO2/c1-14(2)13-21-17(20(3,4)5)12-16(19(22)23-6)18(21)15-10-8-7-9-11-15/h7-12,14H,13H2,1-6H3