3-methyl-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-2H-1-benzofuran-6-carboxylate

Systemtic Name: 3-methyl-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-2H-1-benzofuran-6-carboxylate Openeye Name: 3-methyl-3-(1,1,4,4,7-pentamethyltetralin-6-yl)-2H-benzofuran-6-carboxylate CAS Name: 3-methyl-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-2H-benzofuran-6-carboxylate IUPAC Name: 3-methyl-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-2H-1-benzofuran-6-carboxylate Traditional Name: 3-methyl-3-(1,1,4,4,7-pentamethyltetralin-6-yl)coumaran-6-carboxylate Formula: C25H29O3- MolecularWeight: 377.49596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)C3(COC4=C3C=CC(=C4)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)C3(COC4=C3C=CC(=C4)C(=O)[O-])C

InChI

InChI=1S/C25H30O3/c1-15-11-19-20(24(4,5)10-9-23(19,2)3)13-18(15)25(6)14-28-21-12-16(22(26)27)7-8-17(21)25/h7-8,11-13H,9-10,14H2,1-6H3,(H,26,27)/p-1