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

Systemtic Name: [3-[(3-cyano-7-methyl-2-oxidanylidene-1H-quinolin-5-yl)oxy]-2-oxidanyl-propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]azanium Openeye Name: [3-[(3-cyano-7-methyl-2-oxo-1H-quinolin-5-yl)oxy]-2-hydroxy-propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]ammonium CAS Name: [3-[(3-cyano-7-methyl-2-oxo-1H-quinolin-5-yl)oxy]-2-hydroxypropyl]-dimethyl-[2-[(5-nitrooxy-1-oxopentyl)amino]ethyl]ammonium IUPAC Name: [3-[(3-cyano-7-methyl-2-oxo-1H-quinolin-5-yl)oxy]-2-hydroxypropyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]azanium Traditional Name: [3-[(3-cyano-2-keto-7-methyl-1H-quinolin-5-yl)oxy]-2-hydroxy-propyl]-dimethyl-[2-(5-nitrooxypentanoylamino)ethyl]ammonium Formula: C23H32N5O7+ MolecularWeight: 490.52948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O7/c1-16-10-20-19(12-17(13-24)23(31)26-20)21(11-16)34-15-18(29)14-28(2,3)8-7-25-22(30)6-4-5-9-35-27(32)33/h10-12,18,29H,4-9,14-15H2,1-3H3,(H-,25,26,30,31)/p+1