6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 6-methoxy-4-[[7-(2-methoxyethyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C28H32N4O6 MolecularWeight: 520.57688

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=C2C(=C(C=C1)NC3=C(C=NC4=CC(=C(C=C43)OC)OCCCN5CCOCC5)C#N)OCO2

Isomeric SMILES

COCCC1=C2C(=C(C=C1)NC3=C(C=NC4=CC(=C(C=C43)OC)OCCCN5CCOCC5)C#N)OCO2

InChI

InChI=1S/C28H32N4O6/c1-33-11-6-19-4-5-22(28-27(19)37-18-38-28)31-26-20(16-29)17-30-23-15-25(24(34-2)14-21(23)26)36-10-3-7-32-8-12-35-13-9-32/h4-5,14-15,17H,3,6-13,18H2,1-2H3,(H,30,31)