4-[(5-chloranyl-1-benzofuran-4-yl)amino]-5-(oxan-2-yloxy)-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-[(5-chloranyl-1-benzofuran-4-yl)amino]-5-(oxan-2-yloxy)-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-[(5-chlorobenzofuran-4-yl)amino]-7-(3-pyrrolidin-1-ylpropoxy)-5-tetrahydropyran-2-yloxy-quinoline-3-carbonitrile CAS Name: 4-[(5-chloro-4-benzofuranyl)amino]-5-(2-oxanyloxy)-7-[3-(1-pyrrolidinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-[(5-chloro-1-benzofuran-4-yl)amino]-5-(oxan-2-yloxy)-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-[(5-chlorobenzofuran-4-yl)amino]-7-(3-pyrrolidinopropoxy)-5-tetrahydropyran-2-yloxy-quinoline-3-carbonitrile Formula: C30H31ClN4O4 MolecularWeight: 547.04454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC2=C3C(=CC(=C2)OCCCN4CCCC4)N=CC(=C3NC5=C(C=CC6=C5C=CO6)Cl)C#N

Isomeric SMILES

C1CCOC(C1)OC2=C3C(=CC(=C2)OCCCN4CCCC4)N=CC(=C3NC5=C(C=CC6=C5C=CO6)Cl)C#N

InChI

InChI=1S/C30H31ClN4O4/c31-23-7-8-25-22(9-15-37-25)30(23)34-29-20(18-32)19-33-24-16-21(36-14-5-12-35-10-2-3-11-35)17-26(28(24)29)39-27-6-1-4-13-38-27/h7-9,15-17,19,27H,1-6,10-14H2,(H,33,34)