4-[(3-iodanyl-1-benzofuran-7-yl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-iodanyl-1-benzofuran-7-yl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile Openeye Name: 4-[(3-iodobenzofuran-7-yl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile CAS Name: 4-[(3-iodo-7-benzofuranyl)amino]-6,7-dimethoxy-3-quinolinecarbonitrile IUPAC Name: 4-[(3-iodo-1-benzofuran-7-yl)amino]-6,7-dimethoxyquinoline-3-carbonitrile Traditional Name: 4-[(3-iodobenzofuran-7-yl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile Formula: C20H14IN3O3 MolecularWeight: 471.24793

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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=C4I)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=CC4=C3OC=C4I)OC

InChI

InChI=1S/C20H14IN3O3/c1-25-17-6-13-16(7-18(17)26-2)23-9-11(8-22)19(13)24-15-5-3-4-12-14(21)10-27-20(12)15/h3-7,9-10H,1-2H3,(H,23,24)