methyl 2,2,4,6,7-pentamethyl-5-(4-nitrophenyl)carbonyloxy-3H-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2,2,4,6,7-pentamethyl-5-(4-nitrophenyl)carbonyloxy-3H-1-benzofuran-3-carboxylate Openeye Name: methyl 2,2,4,6,7-pentamethyl-5-(4-nitrobenzoyl)oxy-3H-benzofuran-3-carboxylate CAS Name: 2,2,4,6,7-pentamethyl-5-[(4-nitrophenyl)-oxomethoxy]-3H-benzofuran-3-carboxylic acid methyl ester IUPAC Name: methyl 2,2,4,6,7-pentamethyl-5-(4-nitrobenzoyl)oxy-3H-1-benzofuran-3-carboxylate Traditional Name: 2,2,4,6,7-pentamethyl-5-(4-nitrobenzoyl)oxy-coumaran-3-carboxylic acid methyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C(C(O2)(C)C)C(=O)OC

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C(C(O2)(C)C)C(=O)OC

InChI

InChI=1S/C22H23NO7/c1-11-12(2)19-16(17(21(25)28-6)22(4,5)30-19)13(3)18(11)29-20(24)14-7-9-15(10-8-14)23(26)27/h7-10,17H,1-6H3