4-methyl-5-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-2-oxidanylidene-1-phenethyl-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-5-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-2-oxidanylidene-1-phenethyl-pyridine-3-carbonitrile Openeye Name: 6-hydroxy-4-methyl-5-(morpholin-4-ium-4-ylmethyl)-2-oxo-1-phenethyl-pyridine-3-carbonitrile CAS Name: 6-hydroxy-4-methyl-5-(4-morpholin-4-iumylmethyl)-2-oxo-1-phenethyl-3-pyridinecarbonitrile IUPAC Name: 6-hydroxy-4-methyl-5-(morpholin-4-ium-4-ylmethyl)-2-oxo-1-phenethylpyridine-3-carbonitrile Traditional Name: 6-hydroxy-2-keto-4-methyl-5-(morpholin-4-ium-4-ylmethyl)-1-phenethyl-nicotinonitrile Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C1C[NH+]2CCOCC2)O)CCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=C1C[NH+]2CCOCC2)O)CCC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H23N3O3/c1-15-17(13-21)19(24)23(8-7-16-5-3-2-4-6-16)20(25)18(15)14-22-9-11-26-12-10-22/h2-6,25H,7-12,14H2,1H3/p+1