propan-2-yl 2-methyl-5-(4-nitrophenyl)carbonyloxy-1-benzofuran-3-carboxylate

Systemtic Name: propan-2-yl 2-methyl-5-(4-nitrophenyl)carbonyloxy-1-benzofuran-3-carboxylate Openeye Name: isopropyl 2-methyl-5-(4-nitrobenzoyl)oxy-benzofuran-3-carboxylate CAS Name: 2-methyl-5-[(4-nitrophenyl)-oxomethoxy]-3-benzofurancarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-methyl-5-(4-nitrobenzoyl)oxy-1-benzofuran-3-carboxylate Traditional Name: 2-methyl-5-(4-nitrobenzoyl)oxy-benzofuran-3-carboxylic acid isopropyl ester Formula: C20H17NO7 MolecularWeight: 383.35148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C20H17NO7/c1-11(2)26-20(23)18-12(3)27-17-9-8-15(10-16(17)18)28-19(22)13-4-6-14(7-5-13)21(24)25/h4-11H,1-3H3