N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2,3-dimethyl-2,3-dihydrobenzofuran-7-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2,3-dimethyl-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2,3-dimethyl-coumaran-7-carboxamide Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1C(OC2=C(C=CC=C12)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C21H24N2O6/c1-12-13(2)29-20-15(12)6-5-7-16(20)21(24)22-9-8-14-10-18(27-3)19(28-4)11-17(14)23(25)26/h5-7,10-13H,8-9H2,1-4H3,(H,22,24)