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

Systemtic Name: 1-(5-bromanylpentyl)-7-(phenylmethyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 7-benzyl-1-(5-bromopentyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 1-(5-bromopentyl)-7-(phenylmethyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 7-benzyl-1-(5-bromopentyl)-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 7-benzyl-1-(5-bromopentyl)-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C20H23BrN2O2 MolecularWeight: 403.31282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C(C1=O)C=CN2CCCCCBr)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C2=C(C1=O)C=CN2CCCCCBr)CC3=CC=CC=C3

InChI

InChI=1S/C20H23BrN2O2/c21-11-5-2-6-12-22-13-9-17-18(24)10-14-23(20(25)19(17)22)15-16-7-3-1-4-8-16/h1,3-4,7-9,13H,2,5-6,10-12,14-15H2