ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]benzofuran-2-carboxylate CAS Name: 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]-1-benzofuran-2-carboxylate Traditional Name: 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethylamino]coumarilic acid ethyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NCCNCCCCC3=CNC4=C3C=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NCCNCCCCC3=CNC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C26H28N4O3/c1-2-32-26(31)25-15-20-14-21(7-9-24(20)33-25)29-12-11-28-10-4-3-5-19-17-30-23-8-6-18(16-27)13-22(19)23/h6-9,13-15,17,28-30H,2-5,10-12H2,1H3