3-(2-bromanylphenoxy)-8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(2-bromanylphenoxy)-8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-chromen-4-one Openeye Name: 3-(2-bromophenoxy)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromen-4-one CAS Name: 3-(2-bromophenoxy)-7-hydroxy-8-(4-morpholin-4-iumylmethyl)-1-benzopyran-4-one IUPAC Name: 3-(2-bromophenoxy)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromen-4-one Traditional Name: 3-(2-bromophenoxy)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromone Formula: C20H19BrNO5+ MolecularWeight: 433.27256

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC=CC=C4Br)O

Isomeric SMILES

C1COCC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC=CC=C4Br)O

InChI

InChI=1S/C20H18BrNO5/c21-15-3-1-2-4-17(15)27-18-12-26-20-13(19(18)24)5-6-16(23)14(20)11-22-7-9-25-10-8-22/h1-6,12,23H,7-11H2/p+1