[3-(4-ethoxycarbonylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-bis(prop-2-enyl)azanium

Systemtic Name: [3-(4-ethoxycarbonylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-bis(prop-2-enyl)azanium Openeye Name: diallyl-[[3-(4-ethoxycarbonylphenoxy)-7-hydroxy-2-methyl-4-oxo-chromen-8-yl]methyl]ammonium CAS Name: [3-(4-ethoxycarbonylphenoxy)-7-hydroxy-2-methyl-4-oxo-1-benzopyran-8-yl]methyl-bis(prop-2-enyl)ammonium IUPAC Name: [3-(4-ethoxycarbonylphenoxy)-7-hydroxy-2-methyl-4-oxochromen-8-yl]methyl-bis(prop-2-enyl)azanium Traditional Name: diallyl-[[3-(4-carbethoxyphenoxy)-7-hydroxy-4-keto-2-methyl-chromen-8-yl]methyl]ammonium Formula: C26H28NO6+ MolecularWeight: 450.50362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](CC=C)CC=C)O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](CC=C)CC=C)O)C

InChI

InChI=1S/C26H27NO6/c1-5-14-27(15-6-2)16-21-22(28)13-12-20-23(29)24(17(4)32-25(20)21)33-19-10-8-18(9-11-19)26(30)31-7-3/h5-6,8-13,28H,1-2,7,14-16H2,3-4H3/p+1