3-methyl-7-oxidanyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride

Systemtic Name: 3-methyl-7-oxidanyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride Openeye Name: 7-hydroxy-3-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride CAS Name: 7-hydroxy-3-methyl-8-(1-piperidin-1-iumylmethyl)-1-benzopyran-4-one chloride IUPAC Name: 7-hydroxy-3-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride Traditional Name: 7-hydroxy-3-methyl-8-(piperidin-1-ium-1-ylmethyl)chromone chloride Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C1=O)C=CC(=C2C[NH+]3CCCCC3)O.[Cl-]

Isomeric SMILES

CC1=COC2=C(C1=O)C=CC(=C2C[NH+]3CCCCC3)O.[Cl-]

InChI

InChI=1S/C16H19NO3.ClH/c1-11-10-20-16-12(15(11)19)5-6-14(18)13(16)9-17-7-3-2-4-8-17;/h5-6,10,18H,2-4,7-9H2,1H3;1H