2-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid

Systemtic Name: 2-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid Openeye Name: 2-[(3-bromo-5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid CAS Name: 2-[(3-bromo-5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic acid IUPAC Name: 2-[(3-bromo-5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid Traditional Name: 2-[(3-bromo-6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid Formula: C15H12BrNO4 MolecularWeight: 350.16408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC2=CC=CC=C2C(=O)O)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNC2=CC=CC=C2C(=O)O)C1=O)Br

InChI

InChI=1S/C15H12BrNO4/c1-21-13-7-10(16)6-9(14(13)18)8-17-12-5-3-2-4-11(12)15(19)20/h2-8,17H,1H3,(H,19,20)