[3-(2-methoxyphenoxy)-2-oxidanyl-propyl]-dimethyl-[2-(3-nitrooxybutanoylamino)ethyl]azanium

Systemtic Name: [3-(2-methoxyphenoxy)-2-oxidanyl-propyl]-dimethyl-[2-(3-nitrooxybutanoylamino)ethyl]azanium Openeye Name: [2-hydroxy-3-(2-methoxyphenoxy)propyl]-dimethyl-[2-(3-nitrooxybutanoylamino)ethyl]ammonium CAS Name: [2-hydroxy-3-(2-methoxyphenoxy)propyl]-dimethyl-[2-[(3-nitrooxy-1-oxobutyl)amino]ethyl]ammonium IUPAC Name: [2-hydroxy-3-(2-methoxyphenoxy)propyl]-dimethyl-[2-(3-nitrooxybutanoylamino)ethyl]azanium Traditional Name: [2-hydroxy-3-(2-methoxyphenoxy)propyl]-dimethyl-[2-(3-nitrooxybutanoylamino)ethyl]ammonium Formula: C18H30N3O7+ MolecularWeight: 400.4467

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC[N+](C)(C)CC(COC1=CC=CC=C1OC)O)O[N+](=O)[O-]

Isomeric SMILES

CC(CC(=O)NCC[N+](C)(C)CC(COC1=CC=CC=C1OC)O)O[N+](=O)[O-]

InChI

InChI=1S/C18H29N3O7/c1-14(28-20(24)25)11-18(23)19-9-10-21(2,3)12-15(22)13-27-17-8-6-5-7-16(17)26-4/h5-8,14-15,22H,9-13H2,1-4H3/p+1