tert-butyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-oxo-2H-pyrrole-1-carboxylate CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-oxo-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: 4-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-keto-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(=CC1=O)C2=CC(=C(C=C2)OC)OC3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(=CC1=O)C2=CC(=C(C=C2)OC)OC3CCCC3

InChI

InChI=1S/C21H27NO5/c1-21(2,3)27-20(24)22-13-15(12-19(22)23)14-9-10-17(25-4)18(11-14)26-16-7-5-6-8-16/h9-12,16H,5-8,13H2,1-4H3