5-(hydroxymethyl)-2-methyl-4-[[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]methylidene]pyridin-3-one

Systemtic Name: 5-(hydroxymethyl)-2-methyl-4-[[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]methylidene]pyridin-3-one Openeye Name: 5-(hydroxymethyl)-2-methyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylene]pyridin-3-one CAS Name: 5-(hydroxymethyl)-2-methyl-4-[[4-(1-pyrrolidin-1-iumylmethyl)anilino]methylidene]-3-pyridinone IUPAC Name: 5-(hydroxymethyl)-2-methyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylidene]pyridin-3-one Traditional Name: 2-methyl-5-methylol-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylene]pyridin-3-one Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC2=CC=C(C=C2)C[NH+]3CCCC3)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNC2=CC=C(C=C2)C[NH+]3CCCC3)C1=O)CO

InChI

InChI=1S/C19H23N3O2/c1-14-19(24)18(16(13-23)10-20-14)11-21-17-6-4-15(5-7-17)12-22-8-2-3-9-22/h4-7,10-11,21,23H,2-3,8-9,12-13H2,1H3/p+1