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

Systemtic Name: 2-azanyl-4-(5-bromanyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-keto-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C24H21BrN2O4 MolecularWeight: 481.33854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CC(C3)C4=CC=CC=C4)N)C#N)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CC(C3)C4=CC=CC=C4)N)C#N)Br)OC

InChI

InChI=1S/C24H21BrN2O4/c1-29-19-11-20(30-2)17(25)10-15(19)22-16(12-26)24(27)31-21-9-14(8-18(28)23(21)22)13-6-4-3-5-7-13/h3-7,10-11,14,22H,8-9,27H2,1-2H3