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

Systemtic Name: 2-[5-(4-cyanophenyl)-2,3-dihydro-1-benzofuran-2-yl]ethyl methanesulfonate Openeye Name: 2-[5-(4-cyanophenyl)-2,3-dihydrobenzofuran-2-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[5-(4-cyanophenyl)-2,3-dihydrobenzofuran-2-yl]ethyl ester IUPAC Name: 2-[5-(4-cyanophenyl)-2,3-dihydro-1-benzofuran-2-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[5-(4-cyanophenyl)coumaran-2-yl]ethyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1CC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)OCCC1CC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H17NO4S/c1-24(20,21)22-9-8-17-11-16-10-15(6-7-18(16)23-17)14-4-2-13(12-19)3-5-14/h2-7,10,17H,8-9,11H2,1H3