5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-styryl]oxazole-4-carbonitrile CAS Name: 5-(4-methyl-1-piperazin-4-iumyl)-2-[(E)-2-phenylethenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-styryl]oxazole-4-carbonitrile Formula: C17H19N4O+ MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(N=C(O2)C=CC3=CC=CC=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O/c1-20-9-11-21(12-10-20)17-15(13-18)19-16(22-17)8-7-14-5-3-2-4-6-14/h2-8H,9-12H2,1H3/p+1/b8-7+