2-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(6,7-dimethoxy-1-methyl-isochroman-1-yl)phenyl]acetic acid CAS Name: 2-[4-(6,7-dimethoxy-1-methyl-3,4-dihydro-1H-2-benzopyran-1-yl)phenyl]acetic acid IUPAC Name: 2-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)phenyl]acetic acid Traditional Name: 2-[4-(6,7-dimethoxy-1-methyl-isochroman-1-yl)phenyl]acetic acid Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C=C2CCO1)OC)OC)C3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

CC1(C2=CC(=C(C=C2CCO1)OC)OC)C3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C20H22O5/c1-20(15-6-4-13(5-7-15)10-19(21)22)16-12-18(24-3)17(23-2)11-14(16)8-9-25-20/h4-7,11-12H,8-10H2,1-3H3,(H,21,22)