[7-azanyl-3-[[(2-methyl-3-oxidanylidene-butan-2-yl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] ethanoate

Systemtic Name: [7-azanyl-3-[[(2-methyl-3-oxidanylidene-butan-2-yl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] ethanoate Openeye Name: [7-amino-3-[[(1,1-dimethyl-2-oxo-propyl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] acetate CAS Name: acetic acid [7-amino-3-[[(2-methyl-3-oxobutan-2-yl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] ester IUPAC Name: [7-amino-3-[[(2-methyl-3-oxobutan-2-yl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] acetate Traditional Name: acetic acid [7-amino-3-[[(2-keto-1,1-dimethyl-propyl)amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-yl] ester Formula: C17H24N2O5 MolecularWeight: 336.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)NCC1(COC2=C(C=C(C=C2)N)OC1)OC(=O)C

Isomeric SMILES

CC(=O)C(C)(C)NCC1(COC2=C(C=C(C=C2)N)OC1)OC(=O)C

InChI

InChI=1S/C17H24N2O5/c1-11(20)16(3,4)19-8-17(24-12(2)21)9-22-14-6-5-13(18)7-15(14)23-10-17/h5-7,19H,8-10,18H2,1-4H3