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

Systemtic Name: 8-[(dimethylazaniumyl)methyl]-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-olate Openeye Name: 3-benzyl-8-[(dimethylammonio)methyl]-4-methyl-2-oxo-chromen-7-olate CAS Name: 8-[(dimethylammonio)methyl]-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-olate IUPAC Name: 3-benzyl-8-[(dimethylazaniumyl)methyl]-4-methyl-2-oxochromen-7-olate Traditional Name: 3-benzyl-8-[(dimethylammonio)methyl]-2-keto-4-methyl-chromen-7-olate Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH+](C)C)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH+](C)C)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3/c1-13-15-9-10-18(22)17(12-21(2)3)19(15)24-20(23)16(13)11-14-7-5-4-6-8-14/h4-10,22H,11-12H2,1-3H3