4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carbonitrile

Systemtic Name: 4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carbonitrile Openeye Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carbonitrile CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-(dimethylamino)-4H-1-benzopyran-3-carbonitrile IUPAC Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-(dimethylamino)-4H-chromene-3-carbonitrile Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carbonitrile Formula: C20H19BrN2O3 MolecularWeight: 415.28046

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(C(=CO2)C#N)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(C(=CO2)C#N)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C20H19BrN2O3/c1-23(2)14-5-6-15-17(9-14)26-11-13(10-22)19(15)12-7-16(21)20(25-4)18(8-12)24-3/h5-9,11,19H,1-4H3