[7-chloranyl-2-[(4-hydroxyphenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4-yl] ethanoate

Systemtic Name: [7-chloranyl-2-[(4-hydroxyphenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4-yl] ethanoate Openeye Name: [7-chloro-2-[(4-hydroxyphenyl)methyl]-3-methyl-5-propyl-benzofuran-4-yl] acetate CAS Name: acetic acid [7-chloro-2-[(4-hydroxyphenyl)methyl]-3-methyl-5-propyl-4-benzofuranyl] ester IUPAC Name: [7-chloro-2-[(4-hydroxyphenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4-yl] acetate Traditional Name: acetic acid [7-chloro-2-(4-hydroxybenzyl)-3-methyl-5-propyl-benzofuran-4-yl] ester Formula: C21H21ClO4 MolecularWeight: 372.84204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C2C(=C1OC(=O)C)C(=C(O2)CC3=CC=C(C=C3)O)C)Cl

Isomeric SMILES

CCCC1=CC(=C2C(=C1OC(=O)C)C(=C(O2)CC3=CC=C(C=C3)O)C)Cl

InChI

InChI=1S/C21H21ClO4/c1-4-5-15-11-17(22)21-19(20(15)25-13(3)23)12(2)18(26-21)10-14-6-8-16(24)9-7-14/h6-9,11,24H,4-5,10H2,1-3H3