4-[(dimethylazaniumyl)methyl]-3-thiophen-2-ylcarbonyl-benzo[g][1]benzofuran-5-olate

Systemtic Name: 4-[(dimethylazaniumyl)methyl]-3-thiophen-2-ylcarbonyl-benzo[g][1]benzofuran-5-olate Openeye Name: 4-[(dimethylammonio)methyl]-3-(thiophene-2-carbonyl)benzo[g]benzofuran-5-olate CAS Name: 4-[(dimethylammonio)methyl]-3-[oxo(thiophen-2-yl)methyl]-5-benzo[g]benzofuranolate IUPAC Name: 4-[(dimethylazaniumyl)methyl]-3-(thiophene-2-carbonyl)benzo[g][1]benzofuran-5-olate Traditional Name: 4-[(dimethylammonio)methyl]-3-(2-thenoyl)benzo[g]benzofuran-5-olate Formula: C20H17NO3S MolecularWeight: 351.41888

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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=CS4)[O-]

Isomeric SMILES

C[NH+](C)CC1=C(C2=CC=CC=C2C3=C1C(=CO3)C(=O)C4=CC=CS4)[O-]

InChI

InChI=1S/C20H17NO3S/c1-21(2)10-14-17-15(19(23)16-8-5-9-25-16)11-24-20(17)13-7-4-3-6-12(13)18(14)22/h3-9,11,22H,10H2,1-2H3