1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-7-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione

Systemtic Name: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-7-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-7-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 1-[4-[4-(4-fluorophenyl)-1-piperazinyl]butyl]-7-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-7-methyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 1-[4-[4-(4-fluorophenyl)piperazino]butyl]-7-methyl-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C23H29FN4O2 MolecularWeight: 412.500363

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)C2=C(C1=O)N(C=C2)CCCCN3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN1CCC(=O)C2=C(C1=O)N(C=C2)CCCCN3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H29FN4O2/c1-25-12-9-21(29)20-8-13-28(22(20)23(25)30)11-3-2-10-26-14-16-27(17-15-26)19-6-4-18(24)5-7-19/h4-8,13H,2-3,9-12,14-17H2,1H3