ethyl 5-methoxy-2-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-carboxylate; hydron; chloride

Systemtic Name: ethyl 5-methoxy-2-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-carboxylate; hydron; chloride Openeye Name: ethyl 5-methoxy-2-[(4-methylpiperazin-1-yl)methyl]benzofuran-3-carboxylate; hydron; chloride CAS Name: hydron; 5-methoxy-2-[(4-methyl-1-piperazinyl)methyl]-3-benzofurancarboxylic acid ethyl ester; chloride IUPAC Name: ethyl 5-methoxy-2-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-carboxylate; hydron; chloride Traditional Name: hydron; 5-methoxy-2-[(4-methylpiperazino)methyl]benzofuran-3-carboxylic acid ethyl ester; chloride Formula: C18H25ClN2O4 MolecularWeight: 368.8551

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Descriptors Computed from Structure

Canonical SMILES:

[H+].CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)CN3CCN(CC3)C.[Cl-]

Isomeric SMILES

[H+].CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)CN3CCN(CC3)C.[Cl-]

InChI

InChI=1S/C18H24N2O4.ClH/c1-4-23-18(21)17-14-11-13(22-3)5-6-15(14)24-16(17)12-20-9-7-19(2)8-10-20;/h5-6,11H,4,7-10,12H2,1-3H3;1H