2-azanyl-4-(5-bromanyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CCC3)N)C#N)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CCC3)N)C#N)Br)OC

InChI

InChI=1S/C18H17BrN2O4/c1-23-14-7-15(24-2)11(19)6-9(14)16-10(8-20)18(21)25-13-5-3-4-12(22)17(13)16/h6-7,16H,3-5,21H2,1-2H3