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

Systemtic Name: 1-(3-bromanylpropyl)-7-(phenylmethyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 7-benzyl-1-(3-bromopropyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 1-(3-bromopropyl)-7-(phenylmethyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 7-benzyl-1-(3-bromopropyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 7-benzyl-1-(3-bromopropyl)-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C18H19BrN2O2 MolecularWeight: 375.25966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C(C1=O)C=CN2CCCBr)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C2=C(C1=O)C=CN2CCCBr)CC3=CC=CC=C3

InChI

InChI=1S/C18H19BrN2O2/c19-9-4-10-20-11-7-15-16(22)8-12-21(18(23)17(15)20)13-14-5-2-1-3-6-14/h1-3,5-7,11H,4,8-10,12-13H2