ethyl 3-methyl-4-(2-oxidanyl-3-piperazin-1-yl-propoxy)-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-(2-oxidanyl-3-piperazin-1-yl-propoxy)-1-benzofuran-2-carboxylate Openeye Name: ethyl 4-(2-hydroxy-3-piperazin-1-yl-propoxy)-3-methyl-benzofuran-2-carboxylate CAS Name: 4-[2-hydroxy-3-(1-piperazinyl)propoxy]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-hydroxy-3-piperazin-1-ylpropoxy)-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-(2-hydroxy-3-piperazino-propoxy)-3-methyl-coumarilic acid ethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCC(CN3CCNCC3)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCC(CN3CCNCC3)O)C

InChI

InChI=1S/C19H26N2O5/c1-3-24-19(23)18-13(2)17-15(5-4-6-16(17)26-18)25-12-14(22)11-21-9-7-20-8-10-21/h4-6,14,20,22H,3,7-12H2,1-2H3