4-[[4-(furan-2-ylmethyl)phenyl]amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-[[4-(furan-2-ylmethyl)phenyl]amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-[4-(2-furylmethyl)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 4-[4-(2-furanylmethyl)anilino]-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-[4-(furan-2-ylmethyl)anilino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-[4-(2-furfuryl)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=C(C=C3)CC4=CC=CO4)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=C(C=C3)CC4=CC=CO4)OCCCN5CCOCC5

InChI

InChI=1S/C29H30N4O4/c1-34-27-17-25-26(18-28(27)37-13-3-9-33-10-14-35-15-11-33)31-20-22(19-30)29(25)32-23-7-5-21(6-8-23)16-24-4-2-12-36-24/h2,4-8,12,17-18,20H,3,9-11,13-16H2,1H3,(H,31,32)