(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-methyl-[2-(3-methylphenoxy)ethyl]ammonium Formula: C22H26NO3+ MolecularWeight: 352.44674

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(=C3C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC[NH+](C)CC2=CC(=O)OC3=C2C=CC(=C3C)C

InChI

InChI=1S/C22H25NO3/c1-15-6-5-7-19(12-15)25-11-10-23(4)14-18-13-21(24)26-22-17(3)16(2)8-9-20(18)22/h5-9,12-13H,10-11,14H2,1-4H3/p+1