1-[2-(3-methoxy-4-oxidanyl-phenyl)-3-pyrrolidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-yl]-2-pyrrolidin-2-yl-ethanone

Systemtic Name: 1-[2-(3-methoxy-4-oxidanyl-phenyl)-3-pyrrolidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-yl]-2-pyrrolidin-2-yl-ethanone Openeye Name: 1-[2-(4-hydroxy-3-methoxy-phenyl)-3-pyrrolidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-yl]-2-pyrrolidin-2-yl-ethanone CAS Name: 1-[2-(4-hydroxy-3-methoxyphenyl)-3-(2-pyrrolidinyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-(2-pyrrolidinyl)ethanone IUPAC Name: 1-[2-(4-hydroxy-3-methoxyphenyl)-3-pyrrolidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-yl]-2-pyrrolidin-2-ylethanone Traditional Name: 1-[2-(4-hydroxy-3-methoxy-phenyl)-3-pyrrolidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-yl]-2-pyrrolidin-2-yl-ethanone Formula: C25H30N2O5 MolecularWeight: 438.5161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=CC(=C3)C(=O)CC4CCCN4)C5CCCN5)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=CC(=C3)C(=O)CC4CCCN4)C5CCCN5)O

InChI

InChI=1S/C25H30N2O5/c1-30-22-13-16(6-8-19(22)28)24-25(18-5-3-11-27-18)32-23-12-15(7-9-21(23)31-24)20(29)14-17-4-2-10-26-17/h6-9,12-13,17-18,24-28H,2-5,10-11,14H2,1H3