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

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-1,6,7,8-tetrahydroquinoline-2,5-dione IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-quinone Formula: C22H25N3O3 MolecularWeight: 379.4522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(CCCC4=O)NC3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(CCCC4=O)NC3=O)C

InChI

InChI=1S/C22H25N3O3/c1-14-5-3-7-19(15(14)2)24-9-11-25(12-10-24)22(28)17-13-16-18(23-21(17)27)6-4-8-20(16)26/h3,5,7,13H,4,6,8-12H2,1-2H3,(H,23,27)