3-(4-bromophenyl)-8-[(dimethylazaniumyl)methyl]-2-methyl-4-oxidanylidene-chromen-7-olate

Systemtic Name: 3-(4-bromophenyl)-8-[(dimethylazaniumyl)methyl]-2-methyl-4-oxidanylidene-chromen-7-olate Openeye Name: 3-(4-bromophenyl)-8-[(dimethylammonio)methyl]-2-methyl-4-oxo-chromen-7-olate CAS Name: 3-(4-bromophenyl)-8-[(dimethylammonio)methyl]-2-methyl-4-oxo-1-benzopyran-7-olate IUPAC Name: 3-(4-bromophenyl)-8-[(dimethylazaniumyl)methyl]-2-methyl-4-oxochromen-7-olate Traditional Name: 3-(4-bromophenyl)-8-[(dimethylammonio)methyl]-4-keto-2-methyl-chromen-7-olate Formula: C19H18BrNO3 MolecularWeight: 388.25512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)[O-])C[NH+](C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)[O-])C[NH+](C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrNO3/c1-11-17(12-4-6-13(20)7-5-12)18(23)14-8-9-16(22)15(10-21(2)3)19(14)24-11/h4-9,22H,10H2,1-3H3