dimethyl-[3-[(7-methyl-2-oxidanylidene-1H-quinolin-5-yl)oxy]-2-oxidanyl-propyl]-[2-(5-nitrooxypentanoylamino)ethyl]azanium

Systemtic Name: dimethyl-[3-[(7-methyl-2-oxidanylidene-1H-quinolin-5-yl)oxy]-2-oxidanyl-propyl]-[2-(5-nitrooxypentanoylamino)ethyl]azanium Openeye Name: [2-hydroxy-3-[(7-methyl-2-oxo-1H-quinolin-5-yl)oxy]propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]ammonium CAS Name: [2-hydroxy-3-[(7-methyl-2-oxo-1H-quinolin-5-yl)oxy]propyl]-dimethyl-[2-[(5-nitrooxy-1-oxopentyl)amino]ethyl]ammonium IUPAC Name: [2-hydroxy-3-[(7-methyl-2-oxo-1H-quinolin-5-yl)oxy]propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]azanium Traditional Name: [2-hydroxy-3-[(2-keto-7-methyl-1H-quinolin-5-yl)oxy]propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]ammonium Formula: C22H33N4O7+ MolecularWeight: 465.52002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=O)N2)C(=C1)OCC(C[N+](C)(C)CCNC(=O)CCCCO[N+](=O)[O-])O

Isomeric SMILES

CC1=CC2=C(C=CC(=O)N2)C(=C1)OCC(C[N+](C)(C)CCNC(=O)CCCCO[N+](=O)[O-])O

InChI

InChI=1S/C22H32N4O7/c1-16-12-19-18(7-8-22(29)24-19)20(13-16)32-15-17(27)14-26(2,3)10-9-23-21(28)6-4-5-11-33-25(30)31/h7-8,12-13,17,27H,4-6,9-11,14-15H2,1-3H3,(H-,23,24,28,29)/p+1