[(2R)-2-(azocan-1-ium-1-yl)-2-(4-ethoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-(azocan-1-ium-1-yl)-2-(4-ethoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-(azocan-1-ium-1-yl)-2-(4-ethoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-(1-azocan-1-iumyl)-2-(4-ethoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-(azocan-1-ium-1-yl)-2-(4-ethoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-(azocan-1-ium-1-yl)-2-p-phenetyl-ethyl]ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C[NH3+])[NH+]2CCCCCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](C[NH3+])[NH+]2CCCCCCC2

InChI

InChI=1S/C17H28N2O/c1-2-20-16-10-8-15(9-11-16)17(14-18)19-12-6-4-3-5-7-13-19/h8-11,17H,2-7,12-14,18H2,1H3/p+2/t17-/m0/s1