9-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid

Systemtic Name: 9-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid Openeye Name: 9-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid CAS Name: 9-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxylic acid IUPAC Name: 9-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid Traditional Name: 9-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxylic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(=O)O)OCCCO2

Isomeric SMILES

CC1=C2C(=C(C=C1)C(=O)O)OCCCO2

InChI

InChI=1S/C11H12O4/c1-7-3-4-8(11(12)13)10-9(7)14-5-2-6-15-10/h3-4H,2,5-6H2,1H3,(H,12,13)