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4-[(diethylazaniumyl)methyl]-3-ethoxycarbonyl-2-methyl-benzo[g][1]benzofuran-5-olate

4-[(diethylazaniumyl)methyl]-3-ethoxycarbonyl-2-methyl-benzo[g][1]benzofuran-5-olate

Systemtic Name:4-[(diethylazaniumyl)methyl]-3-ethoxycarbonyl-2-methyl-benzo[g][1]benzofuran-5-olate
Openeye Name:4-[(diethylammonio)methyl]-3-ethoxycarbonyl-2-methyl-benzo[g]benzofuran-5-olate
CAS Name:4-[(diethylammonio)methyl]-3-ethoxycarbonyl-2-methyl-5-benzo[g]benzofuranolate
IUPAC Name:4-[(diethylazaniumyl)methyl]-3-ethoxycarbonyl-2-methylbenzo[g][1]benzofuran-5-olate
Traditional Name:3-carbethoxy-4-[(diethylammonio)methyl]-2-methyl-benzo[g]benzofuran-5-olate
Formula: C21H25NO4
MolecularWeight: 355.4275
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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C2=CC=CC=C2C3=C1C(=C(O3)C)C(=O)OCC)[O-]


Isomeric SMILES

CC[NH+](CC)CC1=C(C2=CC=CC=C2C3=C1C(=C(O3)C)C(=O)OCC)[O-]


InChI

InChI=1S/C21H25NO4/c1-5-22(6-2)12-16-18-17(21(24)25-7-3)13(4)26-20(18)15-11-9-8-10-14(15)19(16)23/h8-11,23H,5-7,12H2,1-4H3


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