ethyl 2-tert-butyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-tert-butyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-tert-butyl-5-[(3-nitrophenyl)methoxy]benzofuran-3-carboxylate CAS Name: 2-tert-butyl-5-[(3-nitrophenyl)methoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-tert-butyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate Traditional Name: 2-tert-butyl-5-(3-nitrobenzyl)oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC3=CC(=CC=C3)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC3=CC(=CC=C3)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C22H23NO6/c1-5-27-21(24)19-17-12-16(9-10-18(17)29-20(19)22(2,3)4)28-13-14-7-6-8-15(11-14)23(25)26/h6-12H,5,13H2,1-4H3