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

Systemtic Name: 5-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione Openeye Name: 5-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione CAS Name: 5-[2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl]-1-methyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione IUPAC Name: 5-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione Traditional Name: 5-[2-[4-(4-fluorophenyl)piperazino]ethyl]-1-methyl-6,7-dihydropyrrol[3,2-c]azepine-4,8-quinone Formula: C21H25FN4O2 MolecularWeight: 384.447203

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C(=O)CCN(C2=O)CCN3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C=CC2=C1C(=O)CCN(C2=O)CCN3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H25FN4O2/c1-23-8-6-18-20(23)19(27)7-9-26(21(18)28)15-12-24-10-13-25(14-11-24)17-4-2-16(22)3-5-17/h2-6,8H,7,9-15H2,1H3