ethyl-(1-ethylpiperidin-1-ium-4-yl)-(phenylmethyl)azanium

Systemtic Name: ethyl-(1-ethylpiperidin-1-ium-4-yl)-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-(1-ethylpiperidin-1-ium-4-yl)ammonium CAS Name: ethyl-(1-ethyl-4-piperidin-1-iumyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-(1-ethylpiperidin-1-ium-4-yl)azanium Traditional Name: benzyl-ethyl-(1-ethylpiperidin-1-ium-4-yl)ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)[NH+](CC)CC2=CC=CC=C2

Isomeric SMILES

CC[NH+]1CCC(CC1)[NH+](CC)CC2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-3-17-12-10-16(11-13-17)18(4-2)14-15-8-6-5-7-9-15/h5-9,16H,3-4,10-14H2,1-2H3/p+2