[5-(phenylmethyl)-2,3-dihydro-1-benzofuran-3-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Systemtic Name: [5-(phenylmethyl)-2,3-dihydro-1-benzofuran-3-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Openeye Name: (5-benzyl-2,3-dihydrobenzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid [5-(phenylmethyl)-2,3-dihydrobenzofuran-3-yl] ester IUPAC Name: (5-benzyl-2,3-dihydro-1-benzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid (5-benzylcoumaran-3-yl) ester Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)OC2COC3=C2C=C(C=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)OC2COC3=C2C=C(C=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H28O3/c1-16(2)12-20-23(25(20,3)4)24(26)28-22-15-27-21-11-10-18(14-19(21)22)13-17-8-6-5-7-9-17/h5-12,14,20,22-23H,13,15H2,1-4H3