(5-methyl-2-nitro-phenyl) 1-benzofuran-2-carboxylate

Systemtic Name: (5-methyl-2-nitro-phenyl) 1-benzofuran-2-carboxylate Openeye Name: (5-methyl-2-nitro-phenyl) benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid (5-methyl-2-nitrophenyl) ester IUPAC Name: (5-methyl-2-nitrophenyl) 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (5-methyl-2-nitro-phenyl) ester Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C16H11NO5/c1-10-6-7-12(17(19)20)14(8-10)22-16(18)15-9-11-4-2-3-5-13(11)21-15/h2-9H,1H3