2-azanyl-7-(dimethylamino)-4-(3-iodanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-7-(dimethylamino)-4-(3-iodanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Openeye Name: 2-amino-7-(dimethylamino)-4-(3-iodo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile CAS Name: 2-amino-7-(dimethylamino)-4-(3-iodo-4,5-dimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-7-(dimethylamino)-4-(3-iodo-4,5-dimethoxyphenyl)-4H-chromene-3-carbonitrile Traditional Name: 2-amino-7-(dimethylamino)-4-(3-iodo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Formula: C20H20IN3O3 MolecularWeight: 477.29557

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)I)OC)OC

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)I)OC)OC

InChI

InChI=1S/C20H20IN3O3/c1-24(2)12-5-6-13-16(9-12)27-20(23)14(10-22)18(13)11-7-15(21)19(26-4)17(8-11)25-3/h5-9,18H,23H2,1-4H3