(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]methanone Openeye Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]methanone CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]methanone IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]methanone Traditional Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]methanone Formula: C22H24BrNO5 MolecularWeight: 462.33366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4)OC

InChI

InChI=1S/C22H24BrNO5/c1-3-27-21-16(23)11-15(13-20(21)26-2)22(25)24-8-4-5-17(24)14-6-7-18-19(12-14)29-10-9-28-18/h6-7,11-13,17H,3-5,8-10H2,1-2H3