N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-methyl-5-morpholinosulfonyl-pyridin-1-ium-2-amine CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-5-(4-morpholinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-5-morpholin-4-ylsulfonylpyridin-1-ium-2-amine Traditional Name: (4-benzoxy-3-methoxy-benzyl)-methyl-(5-morpholinosulfonylpyridin-1-ium-2-yl)amine Formula: C25H30N3O5S+ MolecularWeight: 484.5878

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H29N3O5S/c1-27(25-11-9-22(17-26-25)34(29,30)28-12-14-32-15-13-28)18-21-8-10-23(24(16-21)31-2)33-19-20-6-4-3-5-7-20/h3-11,16-17H,12-15,18-19H2,1-2H3/p+1