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

Systemtic Name: 3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione Openeye Name: 3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione CAS Name: 3-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-1,6,7,8-tetrahydroquinoline-2,5-dione IUPAC Name: 3-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione Traditional Name: 3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-quinone Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CC=CC=N4)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CC=CC=N4)C(=O)C1

InChI

InChI=1S/C20H22N4O3/c25-18-6-3-5-17-15(18)12-16(19(26)22-17)20(27)24-10-8-23(9-11-24)13-14-4-1-2-7-21-14/h1-2,4,7,12H,3,5-6,8-11,13H2,(H,22,26)