8-azanyl-6-(3-bromanyl-4,5-dimethoxy-phenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile

Systemtic Name: 8-azanyl-6-(3-bromanyl-4,5-dimethoxy-phenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile Openeye Name: 8-amino-6-(3-bromo-4,5-dimethoxy-phenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile CAS Name: 8-amino-6-(3-bromo-4,5-dimethoxyphenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile IUPAC Name: 8-amino-6-(3-bromo-4,5-dimethoxyphenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile Traditional Name: 8-amino-6-(3-bromo-4,5-dimethoxy-phenyl)-6H-pyrano[2,3-e][1,3]benzoxazole-7-carbonitrile Formula: C19H14BrN3O4 MolecularWeight: 428.23616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)OC=N4)OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)OC=N4)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C19H14BrN3O4/c1-24-14-6-9(5-12(20)18(14)25-2)15-10-3-4-13-16(23-8-26-13)17(10)27-19(22)11(15)7-21/h3-6,8,15H,22H2,1-2H3