phenyl 2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-sulfonate

Systemtic Name: phenyl 2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-sulfonate Openeye Name: phenyl 2,2,4,6,7-pentamethyl-3H-benzofuran-5-sulfonate CAS Name: 2,2,4,6,7-pentamethyl-3H-benzofuran-5-sulfonic acid phenyl ester IUPAC Name: phenyl 2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-sulfonate Traditional Name: 2,2,4,6,7-pentamethylcoumaran-5-sulfonic acid phenyl ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)S(=O)(=O)OC3=CC=CC=C3)C)CC(O2)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1C)S(=O)(=O)OC3=CC=CC=C3)C)CC(O2)(C)C

InChI

InChI=1S/C19H22O4S/c1-12-13(2)18(14(3)16-11-19(4,5)22-17(12)16)24(20,21)23-15-9-7-6-8-10-15/h6-10H,11H2,1-5H3