ethyl 3-[1-(1-benzofuran-2-yl)ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[1-(1-benzofuran-2-yl)ethylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[1-(benzofuran-2-yl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[1-(2-benzofuranyl)ethylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[1-(1-benzofuran-2-yl)ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[1-(benzofuran-2-yl)ethylcarbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C)C2=CC3=CC=CC=C3O2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C)C2=CC3=CC=CC=C3O2)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6/c1-3-27-20(24)15-8-14(9-16(10-15)22(25)26)19(23)21-12(2)18-11-13-6-4-5-7-17(13)28-18/h4-12H,3H2,1-2H3,(H,21,23)