N-methyl-4-(2-methylphenyl)-6-morpholin-4-yl-pyridin-1-ium-3-amine

Systemtic Name: N-methyl-4-(2-methylphenyl)-6-morpholin-4-yl-pyridin-1-ium-3-amine Openeye Name: N-methyl-6-morpholino-4-(o-tolyl)pyridin-1-ium-3-amine CAS Name: N-methyl-4-(2-methylphenyl)-6-(4-morpholinyl)-3-pyridin-1-iumamine IUPAC Name: N-methyl-4-(2-methylphenyl)-6-morpholin-4-ylpyridin-1-ium-3-amine Traditional Name: methyl-[6-morpholino-4-(o-tolyl)pyridin-1-ium-3-yl]amine Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=[NH+]C=C2NC)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=[NH+]C=C2NC)N3CCOCC3

InChI

InChI=1S/C17H21N3O/c1-13-5-3-4-6-14(13)15-11-17(19-12-16(15)18-2)20-7-9-21-10-8-20/h3-6,11-12,18H,7-10H2,1-2H3/p+1