3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Openeye Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one IUPAC Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Traditional Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CN3C(=O)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CN3C(=O)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O2S/c23-19-22(20-18(24-19)17-7-4-12-25-17)14-21-10-8-16(9-11-21)13-15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2/p+1