1-benzofuran-2-yl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone Openeye Name: benzofuran-2-yl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone CAS Name: 2-benzofuranyl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone Traditional Name: benzofuran-2-yl-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]methanone Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=CC=CC=C3O2)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC3=CC=CC=C3O2)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C22H21NO4/c24-22(21-14-16-5-1-2-7-18(16)27-21)23-10-3-6-17(23)15-8-9-19-20(13-15)26-12-4-11-25-19/h1-2,5,7-9,13-14,17H,3-4,6,10-12H2