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

Systemtic Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-oxazole-4-carbonitrile CAS Name: 5-(4-methyl-1-piperazin-4-iumyl)-2-phenyl-4-oxazolecarbonitrile IUPAC Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-oxazole-4-carbonitrile Formula: C15H17N4O+ MolecularWeight: 269.32168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C15H16N4O/c1-18-7-9-19(10-8-18)15-13(11-16)17-14(20-15)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3/p+1