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

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-[(E)-styryl]oxazole-4-carbonitrile CAS Name: 5-(4-ethyl-1-piperazin-4-iumyl)-2-[(E)-2-phenylethenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-[(E)-styryl]oxazole-4-carbonitrile Formula: C18H21N4O+ MolecularWeight: 309.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O/c1-2-21-10-12-22(13-11-21)18-16(14-19)20-17(23-18)9-8-15-6-4-3-5-7-15/h3-9H,2,10-13H2,1H3/p+1/b9-8+