N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6/c1-4-30-20-11-16-9-14(2)31-21(16)12-17(20)13-24-22(26)15-5-6-18(23-7-8-29-3)19(10-15)25(27)28/h5-6,10-12,14,23H,4,7-9,13H2,1-3H3,(H,24,26)