[4-[[(3S)-1-cyclohexylcarbonylpiperidin-3-yl]methoxy]phenyl]methyl-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [4-[[(3S)-1-cyclohexylcarbonylpiperidin-3-yl]methoxy]phenyl]methyl-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [4-[[(3S)-1-(cyclohexanecarbonyl)-3-piperidyl]methoxy]phenyl]methyl-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [4-[[(3S)-1-[cyclohexyl(oxo)methyl]-3-piperidinyl]methoxy]phenyl]methyl-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [4-[[(3S)-1-(cyclohexanecarbonyl)piperidin-3-yl]methoxy]phenyl]methyl-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [4-[[(3S)-1-(cyclohexanecarbonyl)-3-piperidyl]methoxy]benzyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C28H40N3O2+ MolecularWeight: 450.6361

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)CC2=CC=C(C=C2)OCC3CCCN(C3)C(=O)C4CCCCC4

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)CC2=CC=C(C=C2)OC[C@H]3CCCN(C3)C(=O)C4CCCCC4

InChI

InChI=1S/C28H39N3O2/c1-30(19-16-26-11-5-6-17-29-26)20-23-12-14-27(15-13-23)33-22-24-8-7-18-31(21-24)28(32)25-9-3-2-4-10-25/h5-6,11-15,17,24-25H,2-4,7-10,16,18-22H2,1H3/p+1/t24-/m0/s1