1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-ethanoyl-2-methoxy-phenoxy)ethanone

Systemtic Name: 1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-ethanoyl-2-methoxy-phenoxy)ethanone Openeye Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]ethanone CAS Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]ethanone Formula: C24H27NO6 MolecularWeight: 425.47428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCC[C@@H]2C3=CC4=C(C=C3)OCCCO4)OC

InChI

InChI=1S/C24H27NO6/c1-16(26)17-6-8-20(22(13-17)28-2)31-15-24(27)25-10-3-5-19(25)18-7-9-21-23(14-18)30-12-4-11-29-21/h6-9,13-14,19H,3-5,10-12,15H2,1-2H3/t19-/m1/s1