2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-1-benzofuran-3-carbonitrile

Systemtic Name: 2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-1-benzofuran-3-carbonitrile Openeye Name: 5-benzyloxy-2,2,4,6,7-pentamethyl-3H-benzofuran-3-carbonitrile CAS Name: 2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-benzofuran-3-carbonitrile IUPAC Name: 2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-1-benzofuran-3-carbonitrile Traditional Name: 5-benzoxy-2,2,4,6,7-pentamethyl-coumaran-3-carbonitrile Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OCC3=CC=CC=C3)C)C(C(O2)(C)C)C#N

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OCC3=CC=CC=C3)C)C(C(O2)(C)C)C#N

InChI

InChI=1S/C21H23NO2/c1-13-14(2)20-18(17(11-22)21(4,5)24-20)15(3)19(13)23-12-16-9-7-6-8-10-16/h6-10,17H,12H2,1-5H3