3-cyanopropyl biphenylene-1-carboxylate

Systemtic Name: 3-cyanopropyl biphenylene-1-carboxylate Openeye Name: 3-cyanopropyl biphenylene-1-carboxylate CAS Name: 1-biphenylenecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl biphenylene-1-carboxylate Traditional Name: biphenylene-1-carboxylic acid 3-cyanopropyl ester Formula: C17H13NO2 MolecularWeight: 263.29062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C2C(=CC=C3)C(=O)OCCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C2C(=CC=C3)C(=O)OCCCC#N

InChI

InChI=1S/C17H13NO2/c18-10-3-4-11-20-17(19)15-9-5-8-14-12-6-1-2-7-13(12)16(14)15/h1-2,5-9H,3-4,11H2