2-methyl-8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-3-phenyl-chromen-4-one chloride

Systemtic Name: 2-methyl-8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-3-phenyl-chromen-4-one chloride Openeye Name: 7-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-3-phenyl-chromen-4-one chloride CAS Name: 7-hydroxy-2-methyl-8-(4-morpholin-4-iumylmethyl)-3-phenyl-1-benzopyran-4-one chloride IUPAC Name: 7-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-3-phenylchromen-4-one chloride Traditional Name: 7-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-3-phenyl-chromone chloride Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCOCC3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCOCC3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H21NO4.ClH/c1-14-19(15-5-3-2-4-6-15)20(24)16-7-8-18(23)17(21(16)26-14)13-22-9-11-25-12-10-22;/h2-8,23H,9-13H2,1H3;1H