2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,3,4-oxadiazole

Systemtic Name: 2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,3,4-oxadiazole Openeye Name: 2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,3,4-oxadiazole CAS Name: 2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-3-piperidin-1-iumyl]-1,3,4-oxadiazole IUPAC Name: 2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,3,4-oxadiazole Traditional Name: 2-[(4-ethoxyphenoxy)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,3,4-oxadiazole Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=NN=C(O2)C3CCC[NH2+]C3

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=NN=C(O2)[C@H]3CCC[NH2+]C3

InChI

InChI=1S/C16H21N3O3/c1-2-20-13-5-7-14(8-6-13)21-11-15-18-19-16(22-15)12-4-3-9-17-10-12/h5-8,12,17H,2-4,9-11H2,1H3/p+1/t12-/m0/s1