(4-prop-2-enylpiperazin-4-ium-1-yl)-pyridin-4-yl-methanone

Systemtic Name: (4-prop-2-enylpiperazin-4-ium-1-yl)-pyridin-4-yl-methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone CAS Name: (4-prop-2-enyl-1-piperazin-4-iumyl)-pyridin-4-ylmethanone IUPAC Name: (4-prop-2-enylpiperazin-4-ium-1-yl)-pyridin-4-ylmethanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-2-7-15-8-10-16(11-9-15)13(17)12-3-5-14-6-4-12/h2-6H,1,7-11H2/p+1