1-benzamido-4-bromanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid

Systemtic Name: 1-benzamido-4-bromanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid Openeye Name: 1-benzamido-4-bromo-9,10-dioxo-anthracene-2-carboxylic acid CAS Name: 1-benzamido-4-bromo-9,10-dioxo-2-anthracenecarboxylic acid IUPAC Name: 1-benzamido-4-bromo-9,10-dioxoanthracene-2-carboxylic acid Traditional Name: 1-benzamido-4-bromo-9,10-diketo-anthracene-2-carboxylic acid Formula: C22H12BrNO5 MolecularWeight: 450.23838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2C(=O)O)Br)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2C(=O)O)Br)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H12BrNO5/c23-15-10-14(22(28)29)18(24-21(27)11-6-2-1-3-7-11)17-16(15)19(25)12-8-4-5-9-13(12)20(17)26/h1-10H,(H,24,27)(H,28,29)