1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]butane-1,4-dione Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(=O)C2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CC(N(C1)C(=O)CCC(=O)C2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22BrNO4/c23-17-6-3-15(4-7-17)19(25)8-10-22(26)24-11-1-2-18(24)16-5-9-20-21(14-16)28-13-12-27-20/h3-7,9,14,18H,1-2,8,10-13H2