1-[3-(2-azanyl-4-nitro-phenoxy)-2-oxidanyl-propyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[3-(2-azanyl-4-nitro-phenoxy)-2-oxidanyl-propyl]pyrrolidine-2,5-dione Openeye Name: 1-[3-(2-amino-4-nitro-phenoxy)-2-hydroxy-propyl]pyrrolidine-2,5-dione CAS Name: 1-[3-(2-amino-4-nitrophenoxy)-2-hydroxypropyl]pyrrolidine-2,5-dione IUPAC Name: 1-[3-(2-amino-4-nitrophenoxy)-2-hydroxypropyl]pyrrolidine-2,5-dione Traditional Name: 1-[3-(2-amino-4-nitro-phenoxy)-2-hydroxy-propyl]pyrrolidine-2,5-quinone Formula: C13H15N3O6 MolecularWeight: 309.2747

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CC(COC2=C(C=C(C=C2)[N+](=O)[O-])N)O

Isomeric SMILES

C1CC(=O)N(C1=O)CC(COC2=C(C=C(C=C2)[N+](=O)[O-])N)O

InChI

InChI=1S/C13H15N3O6/c14-10-5-8(16(20)21)1-2-11(10)22-7-9(17)6-15-12(18)3-4-13(15)19/h1-2,5,9,17H,3-4,6-7,14H2