3-[1-(phenylmethyl)piperidin-1-ium-1-yl]prop-1-en-1-one

Systemtic Name: 3-[1-(phenylmethyl)piperidin-1-ium-1-yl]prop-1-en-1-one Openeye Name: 3-(1-benzylpiperidin-1-ium-1-yl)prop-1-en-1-one CAS Name: 3-[1-(phenylmethyl)-1-piperidin-1-iumyl]-1-propen-1-one IUPAC Name: 3-(1-benzylpiperidin-1-ium-1-yl)prop-1-en-1-one Traditional Name: 3-(1-benzylpiperidin-1-ium-1-yl)prop-1-en-1-one Formula: C15H20NO+ MolecularWeight: 230.3254

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC=C=O)CC2=CC=CC=C2

Isomeric SMILES

C1CC[N+](CC1)(CC=C=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H20NO/c17-13-7-12-16(10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1,3-4,7-9H,2,5-6,10-12,14H2/q+1