7-(2-methoxyethanoylamino)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid

Systemtic Name: 7-(2-methoxyethanoylamino)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Openeye Name: 7-[(2-methoxyacetyl)amino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid CAS Name: 7-[(2-methoxy-1-oxoethyl)amino]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid IUPAC Name: 7-[(2-methoxyacetyl)amino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Traditional Name: 7-[(2-methoxyacetyl)amino]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=CC2=C(C=C1C(=O)O)OCCCO2

Isomeric SMILES

COCC(=O)NC1=CC2=C(C=C1C(=O)O)OCCCO2

InChI

InChI=1S/C13H15NO6/c1-18-7-12(15)14-9-6-11-10(5-8(9)13(16)17)19-3-2-4-20-11/h5-6H,2-4,7H2,1H3,(H,14,15)(H,16,17)