1-[(4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-yl)amino]anthracene-9,10-dione

Systemtic Name: 1-[(4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-yl)amino]anthracene-9,10-dione Openeye Name: 1-[(4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-yl)amino]anthracene-9,10-dione CAS Name: 1-[[4-nitro-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione IUPAC Name: 1-[(4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-yl)amino]anthracene-9,10-dione Traditional Name: 1-[(7-nitro-6-pyrrolidino-benzofurazan-4-yl)amino]-9,10-anthraquinone Formula: C24H17N5O5 MolecularWeight: 455.42228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C3=NON=C3C(=C2)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C3=NON=C3C(=C2)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O)[N+](=O)[O-]

InChI

InChI=1S/C24H17N5O5/c30-23-13-6-1-2-7-14(13)24(31)19-15(23)8-5-9-16(19)25-17-12-18(28-10-3-4-11-28)22(29(32)33)21-20(17)26-34-27-21/h1-2,5-9,12,25H,3-4,10-11H2