3-[4-(furan-2-ylmethyl)piperazin-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione

Systemtic Name: 3-[4-(furan-2-ylmethyl)piperazin-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione Openeye Name: 3-[4-(2-furylmethyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione CAS Name: 3-[[4-(2-furanylmethyl)-1-piperazinyl]-oxomethyl]-1,6,7,8-tetrahydroquinoline-2,5-dione IUPAC Name: 3-[4-(furan-2-ylmethyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione Traditional Name: 3-[4-(2-furfuryl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-quinone Formula: C19H21N3O4 MolecularWeight: 355.38774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CC=CO4)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CC=CO4)C(=O)C1

InChI

InChI=1S/C19H21N3O4/c23-17-5-1-4-16-14(17)11-15(18(24)20-16)19(25)22-8-6-21(7-9-22)12-13-3-2-10-26-13/h2-3,10-11H,1,4-9,12H2,(H,20,24)