2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-piperidin-1-ylsulfonyl-pyridin-1-ium

Systemtic Name: 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-piperidin-1-ylsulfonyl-pyridin-1-ium Openeye Name: 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-(1-piperidylsulfonyl)pyridin-1-ium CAS Name: 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-(1-piperidinylsulfonyl)pyridin-1-ium IUPAC Name: 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-piperidin-1-ylsulfonylpyridin-1-ium Traditional Name: 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-5-piperidinosulfonyl-pyridin-1-ium Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O2S/c25-27(26,24-13-5-2-6-14-24)20-9-10-21(22-17-20)23-15-11-19(12-16-23)18-7-3-1-4-8-18/h1,3-4,7-11,17H,2,5-6,12-16H2/p+1