(E)-3-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]prop-2-enoate Openeye Name: (E)-3-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-propenoate IUPAC Name: (E)-3-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acrylate Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2C=CC(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2/C=C/C(=O)[O-]

InChI

InChI=1S/C15H20N2O2/c1-2-16-9-11-17(12-10-16)14-6-4-3-5-13(14)7-8-15(18)19/h3-8H,2,9-12H2,1H3,(H,18,19)/b8-7+