2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanoic acid Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetic acid CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetic acid IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetic acid Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)CC(=O)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)CC(=O)O)OC1

InChI

InChI=1S/C11H12O4/c12-11(13)7-8-2-3-9-10(6-8)15-5-1-4-14-9/h2-3,6H,1,4-5,7H2,(H,12,13)