2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-ethoxy-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-ethoxy-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-7-ethoxy-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-7-ethoxy-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-7-ethoxy-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-7-ethoxy-4H-chromene-3-carbonitrile Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C20H19BrN2O4/c1-4-26-12-5-6-13-16(9-12)27-20(23)14(10-22)18(13)11-7-15(21)19(25-3)17(8-11)24-2/h5-9,18H,4,23H2,1-3H3