1-methyl-3-[2-[[1-(3-nitrooxypropoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylic acid

Systemtic Name: 1-methyl-3-[2-[[1-(3-nitrooxypropoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylic acid Openeye Name: 1-methyl-3-[2-[[1-(3-nitrooxypropoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]-2-oxo-imidazolidine-4-carboxylic acid CAS Name: 1-methyl-3-[2-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-1-oxopropyl]-2-oxo-4-imidazolidinecarboxylic acid IUPAC Name: 1-methyl-3-[2-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2-oxoimidazolidine-4-carboxylic acid Traditional Name: 2-keto-1-methyl-3-[2-[[1-(3-nitrooxypropoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]imidazolidine-4-carboxylic acid Formula: C21H28N4O9 MolecularWeight: 480.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C(CN(C1=O)C)C(=O)O)NC(CCC2=CC=CC=C2)C(=O)OCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1C(CN(C1=O)C)C(=O)O)NC(CCC2=CC=CC=C2)C(=O)OCCCO[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O9/c1-14(18(26)24-17(19(27)28)13-23(2)21(24)30)22-16(10-9-15-7-4-3-5-8-15)20(29)33-11-6-12-34-25(31)32/h3-5,7-8,14,16-17,22H,6,9-13H2,1-2H3,(H,27,28)