(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azanide

Systemtic Name: (2-morpholin-4-ylpyridin-1-ium-4-yl)methyl-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azanide Openeye Name: (2-morpholinopyridin-1-ium-4-yl)methyl-tetralin-6-ylsulfonyl-azanide CAS Name: [2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azanide IUPAC Name: (2-morpholin-4-ylpyridin-1-ium-4-yl)methyl-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azanide Traditional Name: (2-morpholinopyridin-1-ium-4-yl)methyl-tetralin-6-ylsulfonyl-azanide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)[N-]CC3=CC(=[NH+]C=C3)N4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)[N-]CC3=CC(=[NH+]C=C3)N4CCOCC4

InChI

InChI=1S/C20H24N3O3S/c24-27(25,19-6-5-17-3-1-2-4-18(17)14-19)22-15-16-7-8-21-20(13-16)23-9-11-26-12-10-23/h5-8,13-14H,1-4,9-12,15H2/q-1/p+1