3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-morpholino-2-oxo-ethyl)ammonium CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-(4-morpholinyl)-2-oxoethyl]ammonium IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-morpholin-4-yl-2-oxoethyl)azanium Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-keto-2-morpholino-ethyl)ammonium Formula: C15H21N2O4+ MolecularWeight: 293.33824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)[NH2+]CC(=O)N3CCOCC3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)[NH2+]CC(=O)N3CCOCC3)OC1

InChI

InChI=1S/C15H20N2O4/c18-15(17-4-8-19-9-5-17)11-16-12-2-3-13-14(10-12)21-7-1-6-20-13/h2-3,10,16H,1,4-9,11H2/p+1