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

Systemtic Name: butyl-[[3-(2-methoxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]-methyl-azanium Openeye Name: butyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxo-chromen-8-yl]methyl]-methyl-ammonium CAS Name: butyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxo-1-benzopyran-8-yl]methyl]-methylammonium IUPAC Name: butyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxochromen-8-yl]methyl]-methylazanium Traditional Name: butyl-[[7-hydroxy-4-keto-3-(2-methoxyphenyl)chromen-8-yl]methyl]-methyl-ammonium Formula: C22H26NO4+ MolecularWeight: 368.44614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3OC)O

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3OC)O

InChI

InChI=1S/C22H25NO4/c1-4-5-12-23(2)13-17-19(24)11-10-16-21(25)18(14-27-22(16)17)15-8-6-7-9-20(15)26-3/h6-11,14,24H,4-5,12-13H2,1-3H3/p+1