2-[2-[(3-phenoxyphenyl)methyl]-1-benzofuran-4-yl]ethanoate; propane

Systemtic Name: 2-[2-[(3-phenoxyphenyl)methyl]-1-benzofuran-4-yl]ethanoate; propane Openeye Name: 2-[2-[(3-phenoxyphenyl)methyl]benzofuran-4-yl]acetate; propane CAS Name: 2-[2-[(3-phenoxyphenyl)methyl]-4-benzofuranyl]acetate; propane IUPAC Name: 2-[2-[(3-phenoxyphenyl)methyl]-1-benzofuran-4-yl]acetate; propane Traditional Name: n-propane; 2-[2-(3-phenoxybenzyl)benzofuran-4-yl]acetate Formula: C26H25O4- MolecularWeight: 401.4743

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Descriptors Computed from Structure

Canonical SMILES:

CCC.C1=CC=C(C=C1)OC2=CC=CC(=C2)CC3=CC4=C(C=CC=C4O3)CC(=O)[O-]

Isomeric SMILES

CCC.C1=CC=C(C=C1)OC2=CC=CC(=C2)CC3=CC4=C(C=CC=C4O3)CC(=O)[O-]

InChI

InChI=1S/C23H18O4.C3H8/c24-23(25)14-17-7-5-11-22-21(17)15-20(27-22)13-16-6-4-10-19(12-16)26-18-8-2-1-3-9-18;1-3-2/h1-12,15H,13-14H2,(H,24,25);3H2,1-2H3/p-1