phenacyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: phenacyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: phenacyl 1-nitro-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-nitro-9,10-dioxo-2-anthracenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 1-nitro-9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketo-1-nitro-anthracene-2-carboxylic acid phenacyl ester Formula: C23H13NO7 MolecularWeight: 415.35182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C23H13NO7/c25-18(13-6-2-1-3-7-13)12-31-23(28)17-11-10-16-19(20(17)24(29)30)22(27)15-9-5-4-8-14(15)21(16)26/h1-11H,12H2