[5-[2-[[3-(2-methoxyphenoxy)-3-methyl-2-oxidanyl-butan-2-yl]amino]ethylamino]-5-oxidanylidene-pentyl] nitrate

Systemtic Name: [5-[2-[[3-(2-methoxyphenoxy)-3-methyl-2-oxidanyl-butan-2-yl]amino]ethylamino]-5-oxidanylidene-pentyl] nitrate Openeye Name: [5-[2-[[1-hydroxy-2-(2-methoxyphenoxy)-1,2-dimethyl-propyl]amino]ethylamino]-5-oxo-pentyl] nitrate CAS Name: nitric acid [5-[2-[[2-hydroxy-3-(2-methoxyphenoxy)-3-methylbutan-2-yl]amino]ethylamino]-5-oxopentyl] ester IUPAC Name: [5-[2-[[2-hydroxy-3-(2-methoxyphenoxy)-3-methylbutan-2-yl]amino]ethylamino]-5-oxopentyl] nitrate Traditional Name: nitric acid [5-[2-[[1-hydroxy-2-(2-methoxyphenoxy)-1,2-dimethyl-propyl]amino]ethylamino]-5-keto-pentyl] ester Formula: C19H31N3O7 MolecularWeight: 413.46534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C)(NCCNC(=O)CCCCO[N+](=O)[O-])O)OC1=CC=CC=C1OC

Isomeric SMILES

CC(C)(C(C)(NCCNC(=O)CCCCO[N+](=O)[O-])O)OC1=CC=CC=C1OC

InChI

InChI=1S/C19H31N3O7/c1-18(2,29-16-10-6-5-9-15(16)27-4)19(3,24)21-13-12-20-17(23)11-7-8-14-28-22(25)26/h5-6,9-10,21,24H,7-8,11-14H2,1-4H3,(H,20,23)