2-[(2S)-1-cyclopentyl-4-[(8-methoxyquinolin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[(8-methoxyquinolin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[(8-methoxy-2-quinolyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[(8-methoxy-2-quinolinyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[(8-methoxyquinolin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-[(8-methoxy-2-quinolyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(C=C2)CN3CC[NH+](C(C3)CCO)C4CCCC4

Isomeric SMILES

COC1=CC=CC2=C1N=C(C=C2)CN3CC[NH+]([C@H](C3)CCO)C4CCCC4

InChI

InChI=1S/C22H31N3O2/c1-27-21-8-4-5-17-9-10-18(23-22(17)21)15-24-12-13-25(19-6-2-3-7-19)20(16-24)11-14-26/h4-5,8-10,19-20,26H,2-3,6-7,11-16H2,1H3/p+1/t20-/m0/s1