2-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-methyl-chromen-4-one chloride

Systemtic Name: 2-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-methyl-chromen-4-one chloride Openeye Name: 2-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-methyl-chromen-4-one chloride CAS Name: 2-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]-3-methyl-1-benzopyran-4-one chloride IUPAC Name: 2-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-methylchromen-4-one chloride Traditional Name: 2-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-methyl-chromone chloride Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)C[NH+]4CCOCC4.[Cl-]

Isomeric SMILES

CC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)C[NH+]4CCOCC4.[Cl-]

InChI

InChI=1S/C22H23NO4.ClH/c1-15-21(24)18-5-3-4-6-20(18)27-22(15)16-7-8-19(25-2)17(13-16)14-23-9-11-26-12-10-23;/h3-8,13H,9-12,14H2,1-2H3;1H