[1-(tert-butylamino)-3-[4-(diethylcarbamoylamino)-2-ethanoyl-phenoxy]propan-2-yl] nitrate

Systemtic Name: [1-(tert-butylamino)-3-[4-(diethylcarbamoylamino)-2-ethanoyl-phenoxy]propan-2-yl] nitrate Openeye Name: [1-[[2-acetyl-4-(diethylcarbamoylamino)phenoxy]methyl]-2-(tert-butylamino)ethyl] nitrate CAS Name: nitric acid [1-[2-acetyl-4-[[diethylamino(oxo)methyl]amino]phenoxy]-3-(tert-butylamino)propan-2-yl] ester IUPAC Name: [1-[2-acetyl-4-(diethylcarbamoylamino)phenoxy]-3-(tert-butylamino)propan-2-yl] nitrate Traditional Name: nitric acid [1-[[2-acetyl-4-(diethylcarbamoylamino)phenoxy]methyl]-2-(tert-butylamino)ethyl] ester Formula: C20H32N4O6 MolecularWeight: 424.49128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C20H32N4O6/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)25)29-13-16(30-24(27)28)12-21-20(4,5)6/h9-11,16,21H,7-8,12-13H2,1-6H3,(H,22,26)