ethyl 2-[5-(2-cyanophenyl)indazol-2-yl]octanoate

Systemtic Name: ethyl 2-[5-(2-cyanophenyl)indazol-2-yl]octanoate Openeye Name: ethyl 2-[5-(2-cyanophenyl)indazol-2-yl]octanoate CAS Name: 2-[5-(2-cyanophenyl)-2-indazolyl]octanoic acid ethyl ester IUPAC Name: ethyl 2-[5-(2-cyanophenyl)indazol-2-yl]octanoate Traditional Name: 2-[5-(2-cyanophenyl)indazol-2-yl]caprylic acid ethyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OCC)N1C=C2C=C(C=CC2=N1)C3=CC=CC=C3C#N

Isomeric SMILES

CCCCCCC(C(=O)OCC)N1C=C2C=C(C=CC2=N1)C3=CC=CC=C3C#N

InChI

InChI=1S/C24H27N3O2/c1-3-5-6-7-12-23(24(28)29-4-2)27-17-20-15-18(13-14-22(20)26-27)21-11-9-8-10-19(21)16-25/h8-11,13-15,17,23H,3-7,12H2,1-2H3