[3-[[(3S)-1-cyclohexylcarbonylpiperidin-3-yl]methoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium

Systemtic Name: [3-[[(3S)-1-cyclohexylcarbonylpiperidin-3-yl]methoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Openeye Name: [3-[[(3S)-1-(cyclohexanecarbonyl)-3-piperidyl]methoxy]phenyl]methyl-methyl-(6-quinolylmethyl)ammonium CAS Name: [3-[[(3S)-1-[cyclohexyl(oxo)methyl]-3-piperidinyl]methoxy]phenyl]methyl-methyl-(6-quinolinylmethyl)ammonium IUPAC Name: [3-[[(3S)-1-(cyclohexanecarbonyl)piperidin-3-yl]methoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Traditional Name: [3-[[(3S)-1-(cyclohexanecarbonyl)-3-piperidyl]methoxy]benzyl]-methyl-(6-quinolylmethyl)ammonium Formula: C31H40N3O2+ MolecularWeight: 486.6682

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OCC2CCCN(C2)C(=O)C3CCCCC3)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC[C@H]2CCCN(C2)C(=O)C3CCCCC3)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C31H39N3O2/c1-33(21-25-14-15-30-28(18-25)12-6-16-32-30)20-24-8-5-13-29(19-24)36-23-26-9-7-17-34(22-26)31(35)27-10-3-2-4-11-27/h5-6,8,12-16,18-19,26-27H,2-4,7,9-11,17,20-23H2,1H3/p+1/t26-/m0/s1