(4-nitrophenyl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid (4-nitrobenzyl) ester Formula: C18H15NO6 MolecularWeight: 341.3148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15NO6/c1-11-15-9-14(23-2)7-8-16(15)25-17(11)18(20)24-10-12-3-5-13(6-4-12)19(21)22/h3-9H,10H2,1-2H3