ethyl 2-[[4-[(3-ethoxycarbonyl-5-oxidanyl-1-benzofuran-2-yl)methyl]piperazin-1-yl]methyl]-5-oxidanyl-1-benzofuran-3-carboxylate dihydrochloride

Systemtic Name: ethyl 2-[[4-[(3-ethoxycarbonyl-5-oxidanyl-1-benzofuran-2-yl)methyl]piperazin-1-yl]methyl]-5-oxidanyl-1-benzofuran-3-carboxylate dihydrochloride Openeye Name: ethyl 2-[[4-[(3-ethoxycarbonyl-5-hydroxy-benzofuran-2-yl)methyl]piperazin-1-yl]methyl]-5-hydroxy-benzofuran-3-carboxylate dihydrochloride CAS Name: 2-[[4-[(3-ethoxycarbonyl-5-hydroxy-2-benzofuranyl)methyl]-1-piperazinyl]methyl]-5-hydroxy-3-benzofurancarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 2-[[4-[(3-ethoxycarbonyl-5-hydroxy-1-benzofuran-2-yl)methyl]piperazin-1-yl]methyl]-5-hydroxy-1-benzofuran-3-carboxylate dihydrochloride Traditional Name: 2-[[4-[(3-carbethoxy-5-hydroxy-benzofuran-2-yl)methyl]piperazino]methyl]-5-hydroxy-benzofuran-3-carboxylic acid ethyl ester dihydrochloride Formula: C28H32Cl2N2O8 MolecularWeight: 595.46828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CN3CCN(CC3)CC4=C(C5=C(O4)C=CC(=C5)O)C(=O)OCC.Cl.Cl

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CN3CCN(CC3)CC4=C(C5=C(O4)C=CC(=C5)O)C(=O)OCC.Cl.Cl

InChI

InChI=1S/C28H30N2O8.2ClH/c1-3-35-27(33)25-19-13-17(31)5-7-21(19)37-23(25)15-29-9-11-30(12-10-29)16-24-26(28(34)36-4-2)20-14-18(32)6-8-22(20)38-24;;/h5-8,13-14,31-32H,3-4,9-12,15-16H2,1-2H3;2*1H