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

Systemtic Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-7-propyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-7-propyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 5-[4-(4-fluorophenyl)-1-piperazinyl]-1-methyl-7-propyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-7-propyl-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 5-[4-(4-fluorophenyl)piperazino]-1-methyl-7-propyl-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C22H27FN4O2 MolecularWeight: 398.473783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(C(=O)C2=C(C1=O)N(C=C2)C)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCCN1CC(C(=O)C2=C(C1=O)N(C=C2)C)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H27FN4O2/c1-3-9-27-15-19(21(28)18-8-10-24(2)20(18)22(27)29)26-13-11-25(12-14-26)17-6-4-16(23)5-7-17/h4-8,10,19H,3,9,11-15H2,1-2H3