4-(1-benzofuran-7-ylamino)-7-[3,3-bis(fluoranyl)propoxy]-6-methoxy-quinoline-3-carbonitrile

Systemtic Name: 4-(1-benzofuran-7-ylamino)-7-[3,3-bis(fluoranyl)propoxy]-6-methoxy-quinoline-3-carbonitrile Openeye Name: 4-(benzofuran-7-ylamino)-7-(3,3-difluoropropoxy)-6-methoxy-quinoline-3-carbonitrile CAS Name: 4-(7-benzofuranylamino)-7-(3,3-difluoropropoxy)-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 4-(1-benzofuran-7-ylamino)-7-(3,3-difluoropropoxy)-6-methoxyquinoline-3-carbonitrile Traditional Name: 4-(benzofuran-7-ylamino)-7-(3,3-difluoropropoxy)-6-methoxy-quinoline-3-carbonitrile Formula: C22H17F2N3O3 MolecularWeight: 409.385486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=CC4=C3OC=C4)OCCC(F)F

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=CC4=C3OC=C4)OCCC(F)F

InChI

InChI=1S/C22H17F2N3O3/c1-28-18-9-15-17(10-19(18)29-8-6-20(23)24)26-12-14(11-25)21(15)27-16-4-2-3-13-5-7-30-22(13)16/h2-5,7,9-10,12,20H,6,8H2,1H3,(H,26,27)