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

Systemtic Name: 3-[[4-(4-cyclohexylpiperazin-1-yl)carbonylcyclohexyl]methylamino]-4-piperidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[4-(4-cyclohexylpiperazine-1-carbonyl)cyclohexyl]methylamino]-4-(1-piperidyl)cyclobut-3-ene-1,2-dione CAS Name: 3-[[4-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]cyclohexyl]methylamino]-4-(1-piperidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[4-(4-cyclohexylpiperazine-1-carbonyl)cyclohexyl]methylamino]-4-piperidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[4-(4-cyclohexylpiperazine-1-carbonyl)cyclohexyl]methylamino]-4-piperidino-cyclobut-3-ene-1,2-quinone Formula: C27H42N4O3 MolecularWeight: 470.64738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3CCC(CC3)CNC4=C(C(=O)C4=O)N5CCCCC5

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3CCC(CC3)CNC4=C(C(=O)C4=O)N5CCCCC5

InChI

InChI=1S/C27H42N4O3/c32-25-23(24(26(25)33)30-13-5-2-6-14-30)28-19-20-9-11-21(12-10-20)27(34)31-17-15-29(16-18-31)22-7-3-1-4-8-22/h20-22,28H,1-19H2