4-(4-butylpiperazin-1-ium-1-ylidene)-2-(4-butylpiperazin-1-yl)-3-oxidanyl-cyclobut-2-en-1-one hydroxide

Systemtic Name: 4-(4-butylpiperazin-1-ium-1-ylidene)-2-(4-butylpiperazin-1-yl)-3-oxidanyl-cyclobut-2-en-1-one hydroxide Openeye Name: 4-(4-butylpiperazin-1-ium-1-ylidene)-2-(4-butylpiperazin-1-yl)-3-hydroxy-cyclobut-2-en-1-one hydroxide CAS Name: 4-(4-butyl-1-piperazin-1-iumylidene)-2-(4-butyl-1-piperazinyl)-3-hydroxy-1-cyclobut-2-enone hydroxide IUPAC Name: 4-(4-butylpiperazin-1-ium-1-ylidene)-2-(4-butylpiperazin-1-yl)-3-hydroxycyclobut-2-en-1-one hydroxide Traditional Name: 4-(4-butylpiperazin-1-ium-1-ylidene)-2-(4-butylpiperazino)-3-hydroxy-cyclobut-2-en-1-one hydroxide Formula: C20H36N4O3 MolecularWeight: 380.52484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C(=[N+]3CCN(CC3)CCCC)C2=O)O.[OH-]

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C(=[N+]3CCN(CC3)CCCC)C2=O)O.[OH-]

InChI

InChI=1S/C20H34N4O2.H2O/c1-3-5-7-21-9-13-23(14-10-21)17-19(25)18(20(17)26)24-15-11-22(12-16-24)8-6-4-2;/h3-16H2,1-2H3;1H2