3-methyl-N-[2-[4-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[2-[4-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiophene-2-carboxamide Openeye Name: 3-methyl-N-[2-[4-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiophene-2-carboxamide CAS Name: 3-methyl-N-[2-[4-[[(2S)-2-(3-pyridinyl)-1-piperidin-1-iumyl]methyl]phenoxy]ethyl]-2-thiophenecarboxamide IUPAC Name: 3-methyl-N-[2-[4-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiophene-2-carboxamide Traditional Name: 3-methyl-N-[2-[4-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiophene-2-carboxamide Formula: C25H30N3O2S+ MolecularWeight: 436.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NCCOC2=CC=C(C=C2)C[NH+]3CCCCC3C4=CN=CC=C4

Isomeric SMILES

CC1=C(SC=C1)C(=O)NCCOC2=CC=C(C=C2)C[NH+]3CCCC[C@H]3C4=CN=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-19-11-16-31-24(19)25(29)27-13-15-30-22-9-7-20(8-10-22)18-28-14-3-2-6-23(28)21-5-4-12-26-17-21/h4-5,7-12,16-17,23H,2-3,6,13-15,18H2,1H3,(H,27,29)/p+1/t23-/m0/s1