3-(2-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxylic acid

Systemtic Name: 3-(2-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxylic acid Openeye Name: 3-(2-phenylpropyl)-2,3-dihydrobenzofuran-5-carboxylic acid CAS Name: 3-(2-phenylpropyl)-2,3-dihydrobenzofuran-5-carboxylic acid IUPAC Name: 3-(2-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxylic acid Traditional Name: 3-(2-phenylpropyl)coumaran-5-carboxylic acid Formula: C18H18O3 MolecularWeight: 282.33372

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1COC2=C1C=C(C=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(CC1COC2=C1C=C(C=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H18O3/c1-12(13-5-3-2-4-6-13)9-15-11-21-17-8-7-14(18(19)20)10-16(15)17/h2-8,10,12,15H,9,11H2,1H3,(H,19,20)