4-cyano-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid

Systemtic Name: 4-cyano-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid Openeye Name: 4-cyano-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid CAS Name: 4-cyano-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid IUPAC Name: 4-cyano-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid Traditional Name: 4-cyano-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC(OC3=CC=CC(=C31)C#N)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2OC(OC3=CC=CC(=C31)C#N)C(=O)O

InChI

InChI=1S/C16H11NO4/c17-9-11-5-3-7-14-12(11)8-10-4-1-2-6-13(10)20-16(21-14)15(18)19/h1-7,16H,8H2,(H,18,19)