[1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-1-ium-4-yl]-phenyl-methanone

Systemtic Name: [1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-1-ium-4-yl]-phenyl-methanone Openeye Name: [1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-1-ium-4-yl]-phenyl-methanone CAS Name: [1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-4-piperidin-1-iumyl]-phenylmethanone IUPAC Name: [1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-1-ium-4-yl]-phenylmethanone Traditional Name: [1-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-1-ium-4-yl]-phenyl-methanone Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C(C)(C)C)[NH+]2CCC(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=NC(=NO1)C(C)(C)C)[NH+]2CCC(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2/c1-14(18-21-19(22-25-18)20(2,3)4)23-12-10-16(11-13-23)17(24)15-8-6-5-7-9-15/h5-9,14,16H,10-13H2,1-4H3/p+1/t14-/m0/s1