tert-butyl 1-[2-[[1-(3-nitrooxypropoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2-[[1-(3-nitrooxypropoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-[[1-(3-nitrooxypropoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[[1-(3-nitrooxypropoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C25H37N3O8 MolecularWeight: 507.57658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(CCC2=CC=CC=C2)C(=O)OCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(CCC2=CC=CC=C2)C(=O)OCCCO[N+](=O)[O-]

InChI

InChI=1S/C25H37N3O8/c1-18(22(29)27-15-8-12-21(27)24(31)36-25(2,3)4)26-20(14-13-19-10-6-5-7-11-19)23(30)34-16-9-17-35-28(32)33/h5-7,10-11,18,20-21,26H,8-9,12-17H2,1-4H3