N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyl-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyl-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[(6-methoxy-2-naphthyl)methyl]-N-methyl-5-(1-piperidylsulfonyl)pyridin-1-ium-2-amine CAS Name: N-[(6-methoxy-2-naphthalenyl)methyl]-N-methyl-5-(1-piperidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyl-5-piperidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: (6-methoxy-2-naphthyl)methyl-methyl-(5-piperidinosulfonylpyridin-1-ium-2-yl)amine Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H27N3O3S/c1-25(17-18-6-7-20-15-21(29-2)9-8-19(20)14-18)23-11-10-22(16-24-23)30(27,28)26-12-4-3-5-13-26/h6-11,14-16H,3-5,12-13,17H2,1-2H3/p+1