[3-(3,5-dimethylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-methyl-(1-methylpiperidin-4-yl)azanium

Systemtic Name: [3-(3,5-dimethylphenoxy)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-methyl-(1-methylpiperidin-4-yl)azanium Openeye Name: [3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-4-oxo-chromen-8-yl]methyl-methyl-(1-methyl-4-piperidyl)ammonium CAS Name: [3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-4-oxo-1-benzopyran-8-yl]methyl-methyl-(1-methyl-4-piperidinyl)ammonium IUPAC Name: [3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-4-oxochromen-8-yl]methyl-methyl-(1-methylpiperidin-4-yl)azanium Traditional Name: [3-(3,5-dimethylphenoxy)-7-hydroxy-4-keto-2-methyl-chromen-8-yl]methyl-methyl-(1-methyl-4-piperidyl)ammonium Formula: C26H33N2O4+ MolecularWeight: 437.55122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](C)C4CCN(CC4)C)O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](C)C4CCN(CC4)C)O)C)C

InChI

InChI=1S/C26H32N2O4/c1-16-12-17(2)14-20(13-16)32-25-18(3)31-26-21(24(25)30)6-7-23(29)22(26)15-28(5)19-8-10-27(4)11-9-19/h6-7,12-14,19,29H,8-11,15H2,1-5H3/p+1