ethyl 6-bromanyl-5-methoxy-2-methyl-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-4-oxidanyl-1-benzofuran-3-carboxylate dichloride

Systemtic Name: ethyl 6-bromanyl-5-methoxy-2-methyl-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-4-oxidanyl-1-benzofuran-3-carboxylate dichloride Openeye Name: ethyl 6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzofuran-3-carboxylate dichloride CAS Name: 6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-3-benzofurancarboxylic acid ethyl ester dichloride IUPAC Name: ethyl 6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1-benzofuran-3-carboxylate dichloride Traditional Name: 6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzofuran-3-carboxylic acid ethyl ester dichloride Formula: C19H27BrCl2N2O5 MolecularWeight: 514.23808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C(=C2C[NH+]3CC[NH+](CC3)C)Br)OC)O)C.[Cl-].[Cl-]

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C(=C2C[NH+]3CC[NH+](CC3)C)Br)OC)O)C.[Cl-].[Cl-]

InChI

InChI=1S/C19H25BrN2O5.2ClH/c1-5-26-19(24)13-11(2)27-17-12(10-22-8-6-21(3)7-9-22)15(20)18(25-4)16(23)14(13)17;;/h23H,5-10H2,1-4H3;2*1H