2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl(methyl)amino]ethanoic acid

Systemtic Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl(methyl)amino]ethanoic acid Openeye Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl(methyl)amino]acetic acid CAS Name: 2-[[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl(methyl)amino]acetic acid Traditional Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl(methyl)amino]acetic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)NC1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CN(CC(=O)O)C(=O)NC1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C13H16N2O5/c1-15(8-12(16)17)13(18)14-9-3-4-10-11(7-9)20-6-2-5-19-10/h3-4,7H,2,5-6,8H2,1H3,(H,14,18)(H,16,17)