4-(1-benzofuran-7-ylamino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-(1-benzofuran-7-ylamino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-(benzofuran-7-ylamino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 4-(7-benzofuranylamino)-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-(1-benzofuran-7-ylamino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-(benzofuran-7-ylamino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C26H26N4O4 MolecularWeight: 458.50904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=CC4=C3OC=C4)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=CC4=C3OC=C4)OCCCN5CCOCC5

InChI

InChI=1S/C26H26N4O4/c1-31-23-14-20-22(15-24(23)33-10-3-7-30-8-12-32-13-9-30)28-17-19(16-27)25(20)29-21-5-2-4-18-6-11-34-26(18)21/h2,4-6,11,14-15,17H,3,7-10,12-13H2,1H3,(H,28,29)