4-(1H-indol-6-ylamino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-(1H-indol-6-ylamino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-(1H-indol-6-ylamino)-6-methoxy-7-[3-(4-pyridyl)propoxy]quinoline-3-carbonitrile CAS Name: 4-(1H-indol-6-ylamino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)-3-quinolinecarbonitrile IUPAC Name: 4-(1H-indol-6-ylamino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-(1H-indol-6-ylamino)-6-methoxy-7-[3-(4-pyridyl)propoxy]quinoline-3-carbonitrile Formula: C27H23N5O2 MolecularWeight: 449.50382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)C=CN4)OCCCC5=CC=NC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)C=CN4)OCCCC5=CC=NC=C5

InChI

InChI=1S/C27H23N5O2/c1-33-25-14-22-24(15-26(25)34-12-2-3-18-6-9-29-10-7-18)31-17-20(16-28)27(22)32-21-5-4-19-8-11-30-23(19)13-21/h4-11,13-15,17,30H,2-3,12H2,1H3,(H,31,32)