3-morpholin-4-yl-4-[[4-(4-phenylpiperazin-1-yl)carbonylcyclohexyl]methylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-morpholin-4-yl-4-[[4-(4-phenylpiperazin-1-yl)carbonylcyclohexyl]methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-morpholino-4-[[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-(4-morpholinyl)-4-[[4-[oxo-(4-phenyl-1-piperazinyl)methyl]cyclohexyl]methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-morpholin-4-yl-4-[[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-morpholino-4-[[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methylamino]cyclobut-3-ene-1,2-quinone Formula: C26H34N4O4 MolecularWeight: 466.57256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC2=C(C(=O)C2=O)N3CCOCC3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1CNC2=C(C(=O)C2=O)N3CCOCC3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H34N4O4/c31-24-22(23(25(24)32)29-14-16-34-17-15-29)27-18-19-6-8-20(9-7-19)26(33)30-12-10-28(11-13-30)21-4-2-1-3-5-21/h1-5,19-20,27H,6-18H2