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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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