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

Systemtic Name: ethyl-(phenylmethyl)-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: benzyl-ethyl-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: ethyl-(phenylmethyl)-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: benzyl-ethyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: benzyl-ethyl-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2/c1-3-12-18-13-10-17(11-14-18)19(4-2)15-16-8-6-5-7-9-16/h5-9,17H,3-4,10-15H2,1-2H3/p+2