(3-nitrophenyl) 2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (3-nitrophenyl) 2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: (3-nitrophenyl) 2-(6,7-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(6,7-dimethyl-3-benzofuranyl)acetic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-(6,7-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6,7-dimethylbenzofuran-3-yl)acetic acid (3-nitrophenyl) ester Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)OC3=CC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)OC3=CC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H15NO5/c1-11-6-7-16-13(10-23-18(16)12(11)2)8-17(20)24-15-5-3-4-14(9-15)19(21)22/h3-7,9-10H,8H2,1-2H3