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

Systemtic Name: 3-[[2,3-bis(bromanyl)-5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]benzoic acid Openeye Name: 3-[(2,3-dibromo-5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid CAS Name: 3-[(2,3-dibromo-5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic acid IUPAC Name: 3-[(2,3-dibromo-5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid Traditional Name: 3-[(2,3-dibromo-5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid Formula: C16H13Br2NO4 MolecularWeight: 443.08672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C(=CNC2=CC=CC(=C2)C(=O)O)C1=O)Br)Br

Isomeric SMILES

CCOC1=CC(=C(C(=CNC2=CC=CC(=C2)C(=O)O)C1=O)Br)Br

InChI

InChI=1S/C16H13Br2NO4/c1-2-23-13-7-12(17)14(18)11(15(13)20)8-19-10-5-3-4-9(6-10)16(21)22/h3-8,19H,2H2,1H3,(H,21,22)