1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-[(3-phenyl-5-isoxazolyl)methyl]-4-piperidin-1-iumol IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC=CC=C4)O

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC=CC=C4)O

InChI

InChI=1S/C22H28N2O2/c25-22(11-13-24(14-12-22)17-18-7-3-1-4-8-18)16-20-15-21(23-26-20)19-9-5-2-6-10-19/h1-3,5-6,9-10,15,18,25H,4,7-8,11-14,16-17H2/p+1/t18-/m1/s1