[3-[4,4-dimethyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-2-oxidanyl-propyl] 3-nitrobenzoate

Systemtic Name: [3-[4,4-dimethyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-2-oxidanyl-propyl] 3-nitrobenzoate Openeye Name: [3-(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)-2-hydroxy-propyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-hydroxypropyl] ester IUPAC Name: [3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-hydroxypropyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(2,5-diketo-4,4-dimethyl-imidazolidin-1-yl)-2-hydroxy-propyl] ester Formula: C15H17N3O7 MolecularWeight: 351.31138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CC(COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CC(COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])O)C

InChI

InChI=1S/C15H17N3O7/c1-15(2)13(21)17(14(22)16-15)7-11(19)8-25-12(20)9-4-3-5-10(6-9)18(23)24/h3-6,11,19H,7-8H2,1-2H3,(H,16,22)