2-(4-butylcyclohexyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(4-butylcyclohexyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-butylcyclohexyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole-4-carbonitrile CAS Name: 2-(4-butylcyclohexyl)-5-(4-methyl-1-piperazin-4-iumyl)-4-oxazolecarbonitrile IUPAC Name: 2-(4-butylcyclohexyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-butylcyclohexyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole-4-carbonitrile Formula: C19H31N4O+ MolecularWeight: 331.47564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=NC(=C(O2)N3CC[NH+](CC3)C)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C2=NC(=C(O2)N3CC[NH+](CC3)C)C#N

InChI

InChI=1S/C19H30N4O/c1-3-4-5-15-6-8-16(9-7-15)18-21-17(14-20)19(24-18)23-12-10-22(2)11-13-23/h15-16H,3-13H2,1-2H3/p+1