[3-(2-bromanylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-diethyl-azanium

Systemtic Name: [3-(2-bromanylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-diethyl-azanium Openeye Name: [3-(2-bromophenoxy)-7-hydroxy-2-methyl-4-oxo-chromen-8-yl]methyl-diethyl-ammonium CAS Name: [3-(2-bromophenoxy)-7-hydroxy-2-methyl-4-oxo-1-benzopyran-8-yl]methyl-diethylammonium IUPAC Name: [3-(2-bromophenoxy)-7-hydroxy-2-methyl-4-oxochromen-8-yl]methyl-diethylazanium Traditional Name: [3-(2-bromophenoxy)-7-hydroxy-4-keto-2-methyl-chromen-8-yl]methyl-diethyl-ammonium Formula: C21H23BrNO4+ MolecularWeight: 433.31562

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=CC=C3Br)C)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=CC=C3Br)C)O

InChI

InChI=1S/C21H22BrNO4/c1-4-23(5-2)12-15-17(24)11-10-14-19(25)20(13(3)26-21(14)15)27-18-9-7-6-8-16(18)22/h6-11,24H,4-5,12H2,1-3H3/p+1