3-nitro-6-oxidanyl-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one

Systemtic Name: 3-nitro-6-oxidanyl-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Openeye Name: 6-hydroxy-3-nitro-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one CAS Name: 6-hydroxy-3-nitro-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one IUPAC Name: 6-hydroxy-3-nitro-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Traditional Name: 6-hydroxy-3-nitro-5,6-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Formula: C12H9N3O4 MolecularWeight: 259.21756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=C1)C(NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CN2C(=C1)C(NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C12H9N3O4/c16-11-10-2-1-5-14(10)12(17)8-4-3-7(15(18)19)6-9(8)13-11/h1-6,11,13,16H