[3-ethyl-2-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl] methanesulfonate

Systemtic Name: [3-ethyl-2-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl] methanesulfonate Openeye Name: [3-ethyl-2-(4-methylpiperazin-1-yl)-2,3-dihydrobenzofuran-5-yl] methanesulfonate CAS Name: methanesulfonic acid [3-ethyl-2-(4-methyl-1-piperazinyl)-2,3-dihydrobenzofuran-5-yl] ester IUPAC Name: [3-ethyl-2-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-ethyl-2-(4-methylpiperazino)coumaran-5-yl] ester Formula: C16H24N2O4S MolecularWeight: 340.43776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(OC2=C1C=C(C=C2)OS(=O)(=O)C)N3CCN(CC3)C

Isomeric SMILES

CCC1C(OC2=C1C=C(C=C2)OS(=O)(=O)C)N3CCN(CC3)C

InChI

InChI=1S/C16H24N2O4S/c1-4-13-14-11-12(22-23(3,19)20)5-6-15(14)21-16(13)18-9-7-17(2)8-10-18/h5-6,11,13,16H,4,7-10H2,1-3H3