2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanoyl]-3-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanoyl]-3-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetyl]-3-methyl-phenoxy]acetic acid CAS Name: 2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-oxoethyl]-3-methylphenoxy]acetic acid IUPAC Name: 2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetyl]-3-methylphenoxy]acetic acid Traditional Name: 2-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetyl]-3-methyl-phenoxy]acetic acid Formula: C20H20O6 MolecularWeight: 356.3692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)O)C(=O)CC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O)C(=O)CC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H20O6/c1-13-9-15(26-12-20(22)23)4-5-16(13)17(21)10-14-3-6-18-19(11-14)25-8-2-7-24-18/h3-6,9,11H,2,7-8,10,12H2,1H3,(H,22,23)