N-(3,4-dimethylphenyl)-6-morpholin-4-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-6-morpholin-4-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-6-morpholino-pyridin-1-ium-3-carboxamide CAS Name: N-(3,4-dimethylphenyl)-6-(4-morpholinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-6-morpholin-4-ylpyridin-1-ium-3-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-6-morpholino-pyridin-1-ium-3-carboxamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C[NH+]=C(C=C2)N3CCOCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C[NH+]=C(C=C2)N3CCOCC3)C

InChI

InChI=1S/C18H21N3O2/c1-13-3-5-16(11-14(13)2)20-18(22)15-4-6-17(19-12-15)21-7-9-23-10-8-21/h3-6,11-12H,7-10H2,1-2H3,(H,20,22)/p+1