(4-aminocarbonyl-2-nitro-phenyl)methyl 2-(6-methyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-(6-methyl-1-benzofuran-3-yl)ethanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-(6-methylbenzofuran-3-yl)acetate CAS Name: 2-(6-methyl-3-benzofuranyl)acetic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-(6-methyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methylbenzofuran-3-yl)acetic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O6/c1-11-2-5-15-14(10-26-17(15)6-11)8-18(22)27-9-13-4-3-12(19(20)23)7-16(13)21(24)25/h2-7,10H,8-9H2,1H3,(H2,20,23)