8-[(dimethylazaniumyl)methyl]-3-(4-methoxyphenyl)-5-methyl-4-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[(dimethylazaniumyl)methyl]-3-(4-methoxyphenyl)-5-methyl-4-oxidanylidene-chromen-7-olate Openeye Name: 8-[(dimethylammonio)methyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-chromen-7-olate CAS Name: 8-[(dimethylammonio)methyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-1-benzopyran-7-olate IUPAC Name: 8-[(dimethylazaniumyl)methyl]-3-(4-methoxyphenyl)-5-methyl-4-oxochromen-7-olate Traditional Name: 8-[(dimethylammonio)methyl]-4-keto-3-(4-methoxyphenyl)-5-methyl-chromen-7-olate Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=CC=C(C=C3)OC)C[NH+](C)C)[O-]

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=CC=C(C=C3)OC)C[NH+](C)C)[O-]

InChI

InChI=1S/C20H21NO4/c1-12-9-17(22)15(10-21(2)3)20-18(12)19(23)16(11-25-20)13-5-7-14(24-4)8-6-13/h5-9,11,22H,10H2,1-4H3