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

Systemtic Name: 6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C29H30N4O6 MolecularWeight: 530.5717

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Descriptors Computed from Structure

Canonical SMILES:

COCC#CC1=C2C(=C(C=C1)NC3=C(C=NC4=CC(=C(C=C43)OC)OCCCN5CCOCC5)C#N)OCO2

Isomeric SMILES

COCC#CC1=C2C(=C(C=C1)NC3=C(C=NC4=CC(=C(C=C43)OC)OCCCN5CCOCC5)C#N)OCO2

InChI

InChI=1S/C29H30N4O6/c1-34-11-3-5-20-6-7-23(29-28(20)38-19-39-29)32-27-21(17-30)18-31-24-16-26(25(35-2)15-22(24)27)37-12-4-8-33-9-13-36-14-10-33/h6-7,15-16,18H,4,8-14,19H2,1-2H3,(H,31,32)