4-[6-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Openeye Name: 4-[6-(4-benzyl-1-piperidyl)pyridin-1-ium-3-yl]sulfonylmorpholine CAS Name: 4-[[6-[4-(phenylmethyl)-1-piperidinyl]-3-pyridin-1-iumyl]sulfonyl]morpholine IUPAC Name: 4-[6-(4-benzylpiperidin-1-yl)pyridin-1-ium-3-yl]sulfonylmorpholine Traditional Name: 4-[6-(4-benzylpiperidino)pyridin-1-ium-3-yl]sulfonylmorpholine Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N3O3S/c25-28(26,24-12-14-27-15-13-24)20-6-7-21(22-17-20)23-10-8-19(9-11-23)16-18-4-2-1-3-5-18/h1-7,17,19H,8-16H2/p+1