2-(3,5-dimethylphenoxy)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]-methyl-azanium

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]-methyl-azanium Openeye Name: 2-(3,5-dimethylphenoxy)ethyl-[(7-methoxy-2-oxo-chromen-4-yl)methyl]-methyl-ammonium CAS Name: 2-(3,5-dimethylphenoxy)ethyl-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]-methylammonium IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]-methylazanium Traditional Name: 2-(3,5-dimethylphenoxy)ethyl-[(2-keto-7-methoxy-chromen-4-yl)methyl]-methyl-ammonium Formula: C22H26NO4+ MolecularWeight: 368.44614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC[NH+](C)CC2=CC(=O)OC3=C2C=CC(=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC[NH+](C)CC2=CC(=O)OC3=C2C=CC(=C3)OC)C

InChI

InChI=1S/C22H25NO4/c1-15-9-16(2)11-19(10-15)26-8-7-23(3)14-17-12-22(24)27-21-13-18(25-4)5-6-20(17)21/h5-6,9-13H,7-8,14H2,1-4H3/p+1