methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-3-oxidanyl-propanoate

Systemtic Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-3-oxidanyl-propanoate Openeye Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-3-hydroxy-propanoate CAS Name: 2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-3-hydroxypropanoate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)-3-hydroxy-propionic acid methyl ester Formula: C14H17NO6 MolecularWeight: 295.28788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C14H17NO6/c1-19-14(18)10(8-16)15-13(17)9-3-4-11-12(7-9)21-6-2-5-20-11/h3-4,7,10,16H,2,5-6,8H2,1H3,(H,15,17)