7-(4-bromanylbutyl)-1-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione

Systemtic Name: 7-(4-bromanylbutyl)-1-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 7-(4-bromobutyl)-1-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 7-(4-bromobutyl)-1-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 7-(4-bromobutyl)-1-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 7-(4-bromobutyl)-1-methyl-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C13H17BrN2O2 MolecularWeight: 313.19028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C(=O)N(CCC2=O)CCCCBr

Isomeric SMILES

CN1C=CC2=C1C(=O)N(CCC2=O)CCCCBr

InChI

InChI=1S/C13H17BrN2O2/c1-15-8-4-10-11(17)5-9-16(7-3-2-6-14)13(18)12(10)15/h4,8H,2-3,5-7,9H2,1H3