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

Systemtic Name: methyl-(2-pyridin-2-ylethyl)-[[4-[[(3S)-1-thiophen-2-ylcarbonylpiperidin-3-yl]methoxy]phenyl]methyl]azanium Openeye Name: methyl-[2-(2-pyridyl)ethyl]-[[4-[[(3S)-1-(thiophene-2-carbonyl)-3-piperidyl]methoxy]phenyl]methyl]ammonium CAS Name: methyl-[[4-[[(3S)-1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methoxy]phenyl]methyl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: methyl-(2-pyridin-2-ylethyl)-[[4-[[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]methoxy]phenyl]methyl]azanium Traditional Name: methyl-[2-(2-pyridyl)ethyl]-[4-[[(3S)-1-(2-thenoyl)-3-piperidyl]methoxy]benzyl]ammonium Formula: C26H32N3O2S+ MolecularWeight: 450.61618

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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)C4=CC=CS4

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)CC2=CC=C(C=C2)OC[C@H]3CCCN(C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C26H31N3O2S/c1-28(16-13-23-7-2-3-14-27-23)18-21-9-11-24(12-10-21)31-20-22-6-4-15-29(19-22)26(30)25-8-5-17-32-25/h2-3,5,7-12,14,17,22H,4,6,13,15-16,18-20H2,1H3/p+1/t22-/m0/s1