(4R)-2-azanyl-4-(5-bromanyl-1H-indol-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (4R)-2-azanyl-4-(5-bromanyl-1H-indol-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4R)-2-amino-4-(5-bromo-1H-indol-3-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4R)-2-amino-4-(5-bromo-1H-indol-3-yl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-4-(5-bromo-1H-indol-3-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4R)-2-amino-4-(5-bromo-1H-indol-3-yl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C18H14BrN3O2 MolecularWeight: 384.22666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)C3=CNC4=C3C=C(C=C4)Br)C(=O)C1

Isomeric SMILES

C1CC2=C([C@@H](C(=C(O2)N)C#N)C3=CNC4=C3C=C(C=C4)Br)C(=O)C1

InChI

InChI=1S/C18H14BrN3O2/c19-9-4-5-13-10(6-9)12(8-22-13)16-11(7-20)18(21)24-15-3-1-2-14(23)17(15)16/h4-6,8,16,22H,1-3,21H2/t16-/m0/s1