2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)-2H-1-benzofuran-5-ol

Systemtic Name: 2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)-2H-1-benzofuran-5-ol Openeye Name: 2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)-2H-benzofuran-5-ol CAS Name: 2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)-2H-benzofuran-5-ol IUPAC Name: 2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)-2H-1-benzofuran-5-ol Traditional Name: 2-[2-(4-chlorophenyl)ethyl]-3,3-dimethyl-6-(3-phenoxypropyl)coumaran-5-ol Formula: C27H29ClO3 MolecularWeight: 436.97036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=CC(=C(C=C21)O)CCCOC3=CC=CC=C3)CCC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1(C(OC2=CC(=C(C=C21)O)CCCOC3=CC=CC=C3)CCC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H29ClO3/c1-27(2)23-18-24(29)20(7-6-16-30-22-8-4-3-5-9-22)17-25(23)31-26(27)15-12-19-10-13-21(28)14-11-19/h3-5,8-11,13-14,17-18,26,29H,6-7,12,15-16H2,1-2H3