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

Systemtic Name: 2-(4-tert-butylphenyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-tert-butylphenyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole-4-carbonitrile CAS Name: 2-(4-tert-butylphenyl)-5-(4-methyl-1-piperazin-4-iumyl)-4-oxazolecarbonitrile IUPAC Name: 2-(4-tert-butylphenyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-tert-butylphenyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole-4-carbonitrile Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)N3CC[NH+](CC3)C)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)N3CC[NH+](CC3)C)C#N

InChI

InChI=1S/C19H24N4O/c1-19(2,3)15-7-5-14(6-8-15)17-21-16(13-20)18(24-17)23-11-9-22(4)10-12-23/h5-8H,9-12H2,1-4H3/p+1