3-methyl-6-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride

Systemtic Name: 3-methyl-6-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride Openeye Name: 3-methyl-6-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride CAS Name: 3-methyl-6-(4-morpholin-4-iumylmethyl)-2-phenyl-1-benzopyran-4-one chloride IUPAC Name: 3-methyl-6-(morpholin-4-ium-4-ylmethyl)-2-phenylchromen-4-one chloride Traditional Name: 3-methyl-6-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromone chloride Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=C(C=C2)C[NH+]3CCOCC3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=C(C=C2)C[NH+]3CCOCC3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H21NO3.ClH/c1-15-20(23)18-13-16(14-22-9-11-24-12-10-22)7-8-19(18)25-21(15)17-5-3-2-4-6-17;/h2-8,13H,9-12,14H2,1H3;1H