5-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-2,3-dihydrophthalazine-1,4-dione

Systemtic Name: 5-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-2,3-dihydrophthalazine-1,4-dione Openeye Name: 5-[(5-nitro-2-oxo-indol-3-yl)amino]-2,3-dihydrophthalazine-1,4-dione CAS Name: 5-[(5-nitro-2-oxo-3-indolyl)amino]-2,3-dihydrophthalazine-1,4-dione IUPAC Name: 5-[(5-nitro-2-oxoindol-3-yl)amino]-2,3-dihydrophthalazine-1,4-dione Traditional Name: 5-[(2-keto-5-nitro-indol-3-yl)amino]-2,3-dihydrophthalazine-1,4-quinone Formula: C16H9N5O5 MolecularWeight: 351.27316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-])C(=O)NNC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-])C(=O)NNC2=O

InChI

InChI=1S/C16H9N5O5/c22-14-8-2-1-3-11(12(8)15(23)20-19-14)17-13-9-6-7(21(25)26)4-5-10(9)18-16(13)24/h1-6H,(H,19,22)(H,20,23)(H,17,18,24)