(3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium Openeye Name: (3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium CAS Name: (3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium IUPAC Name: (3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium Traditional Name: (3S)-3-[(4-ethylphenoxy)methyl]piperidin-1-ium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2CCC[NH2+]C2

Isomeric SMILES

CCC1=CC=C(C=C1)OC[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H21NO/c1-2-12-5-7-14(8-6-12)16-11-13-4-3-9-15-10-13/h5-8,13,15H,2-4,9-11H2,1H3/p+1/t13-/m0/s1