[4-oxidanylidene-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butyl]azanium

Systemtic Name: [4-oxidanylidene-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butyl]azanium Openeye Name: [4-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-oxo-butyl]ammonium CAS Name: [4-oxo-4-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]butyl]ammonium IUPAC Name: [4-oxo-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butyl]azanium Traditional Name: [4-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-keto-butyl]ammonium Formula: C17H27N3O+2 MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)CCC[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)CCC[NH3+]

InChI

InChI=1S/C17H25N3O/c18-10-4-9-17(21)20-14-12-19(13-15-20)11-5-8-16-6-2-1-3-7-16/h1-3,5-8H,4,9-15,18H2/p+2/b8-5+