7-(aminomethyl)-4-(3-bromanyl-4,5-dimethoxy-phenyl)-2-oxidanylidene-chromene-3-carbonitrile

Systemtic Name: 7-(aminomethyl)-4-(3-bromanyl-4,5-dimethoxy-phenyl)-2-oxidanylidene-chromene-3-carbonitrile Openeye Name: 7-(aminomethyl)-4-(3-bromo-4,5-dimethoxy-phenyl)-2-oxo-chromene-3-carbonitrile CAS Name: 7-(aminomethyl)-4-(3-bromo-4,5-dimethoxyphenyl)-2-oxo-1-benzopyran-3-carbonitrile IUPAC Name: 7-(aminomethyl)-4-(3-bromo-4,5-dimethoxyphenyl)-2-oxochromene-3-carbonitrile Traditional Name: 7-(aminomethyl)-4-(3-bromo-4,5-dimethoxy-phenyl)-2-keto-chromene-3-carbonitrile Formula: C19H15BrN2O4 MolecularWeight: 415.2374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C(=O)OC3=C2C=CC(=C3)CN)C#N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C(=O)OC3=C2C=CC(=C3)CN)C#N)Br)OC

InChI

InChI=1S/C19H15BrN2O4/c1-24-16-7-11(6-14(20)18(16)25-2)17-12-4-3-10(8-21)5-15(12)26-19(23)13(17)9-22/h3-7H,8,21H2,1-2H3