4-[(dimethylazaniumyl)methyl]-3-(4-methoxyphenyl)carbonyl-benzo[g][1]benzofuran-5-olate

Systemtic Name: 4-[(dimethylazaniumyl)methyl]-3-(4-methoxyphenyl)carbonyl-benzo[g][1]benzofuran-5-olate Openeye Name: 4-[(dimethylammonio)methyl]-3-(4-methoxybenzoyl)benzo[g]benzofuran-5-olate CAS Name: 4-[(dimethylammonio)methyl]-3-[(4-methoxyphenyl)-oxomethyl]-5-benzo[g]benzofuranolate IUPAC Name: 4-[(dimethylazaniumyl)methyl]-3-(4-methoxybenzoyl)benzo[g][1]benzofuran-5-olate Traditional Name: 4-[(dimethylammonio)methyl]-3-p-anisoyl-benzo[g]benzofuran-5-olate Formula: C23H21NO4 MolecularWeight: 375.41714

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C2=CC=CC=C2C3=C1C(=CO3)C(=O)C4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

C[NH+](C)CC1=C(C2=CC=CC=C2C3=C1C(=CO3)C(=O)C4=CC=C(C=C4)OC)[O-]

InChI

InChI=1S/C23H21NO4/c1-24(2)12-18-20-19(21(25)14-8-10-15(27-3)11-9-14)13-28-23(20)17-7-5-4-6-16(17)22(18)26/h4-11,13,26H,12H2,1-3H3