(3-methylquinolin-8-yl)sulfonyl-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]azanide

Systemtic Name: (3-methylquinolin-8-yl)sulfonyl-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]azanide Openeye Name: (3-methyl-8-quinolyl)sulfonyl-[(2-morpholinopyridin-1-ium-4-yl)methyl]azanide CAS Name: (3-methyl-8-quinolinyl)sulfonyl-[[2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl]azanide IUPAC Name: (3-methylquinolin-8-yl)sulfonyl-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]azanide Traditional Name: (3-methyl-8-quinolyl)sulfonyl-[(2-morpholinopyridin-1-ium-4-yl)methyl]azanide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)[N-]CC3=CC(=[NH+]C=C3)N4CCOCC4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)[N-]CC3=CC(=[NH+]C=C3)N4CCOCC4

InChI

InChI=1S/C20H21N4O3S/c1-15-11-17-3-2-4-18(20(17)22-13-15)28(25,26)23-14-16-5-6-21-19(12-16)24-7-9-27-10-8-24/h2-6,11-13H,7-10,14H2,1H3/q-1/p+1