2-(3-bromanylphenoxy)ethyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: 2-(3-bromophenoxy)ethyl 1-nitro-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-nitro-9,10-dioxo-2-anthracenecarboxylic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 1-nitro-9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketo-1-nitro-anthracene-2-carboxylic acid 2-(3-bromophenoxy)ethyl ester Formula: C23H14BrNO7 MolecularWeight: 496.26376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCCOC4=CC(=CC=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCCOC4=CC(=CC=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H14BrNO7/c24-13-4-3-5-14(12-13)31-10-11-32-23(28)18-9-8-17-19(20(18)25(29)30)22(27)16-7-2-1-6-15(16)21(17)26/h1-9,12H,10-11H2