N-[8-acetamido-4,5-dinitro-9,10-bis(oxidanylidene)anthracen-1-yl]ethanamide

Systemtic Name: N-[8-acetamido-4,5-dinitro-9,10-bis(oxidanylidene)anthracen-1-yl]ethanamide Openeye Name: N-(8-acetamido-4,5-dinitro-9,10-dioxo-1-anthryl)acetamide CAS Name: N-(8-acetamido-4,5-dinitro-9,10-dioxo-1-anthracenyl)acetamide IUPAC Name: N-(8-acetamido-4,5-dinitro-9,10-dioxoanthracen-1-yl)acetamide Traditional Name: N-(8-acetamido-9,10-diketo-4,5-dinitro-1-anthryl)acetamide Formula: C18H12N4O8 MolecularWeight: 412.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O8/c1-7(23)19-9-3-5-11(21(27)28)15-13(9)17(25)14-10(20-8(2)24)4-6-12(22(29)30)16(14)18(15)26/h3-6H,1-2H3,(H,19,23)(H,20,24)