2-(4-methoxyphenyl)-5-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-chromen-4-one

Systemtic Name: 2-(4-methoxyphenyl)-5-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-chromen-4-one Openeye Name: 6-hydroxy-2-(4-methoxyphenyl)-5-(morpholin-4-ium-4-ylmethyl)chromen-4-one CAS Name: 6-hydroxy-2-(4-methoxyphenyl)-5-(4-morpholin-4-iumylmethyl)-1-benzopyran-4-one IUPAC Name: 6-hydroxy-2-(4-methoxyphenyl)-5-(morpholin-4-ium-4-ylmethyl)chromen-4-one Traditional Name: 6-hydroxy-2-(4-methoxyphenyl)-5-(morpholin-4-ium-4-ylmethyl)chromone Formula: C21H22NO5+ MolecularWeight: 368.40308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3C[NH+]4CCOCC4)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3C[NH+]4CCOCC4)O

InChI

InChI=1S/C21H21NO5/c1-25-15-4-2-14(3-5-15)20-12-18(24)21-16(13-22-8-10-26-11-9-22)17(23)6-7-19(21)27-20/h2-7,12,23H,8-11,13H2,1H3/p+1