(4S)-2-azanyl-4-(5-bromanylfuran-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(5-bromanylfuran-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-(5-bromo-2-furyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4S)-2-amino-4-(5-bromo-2-furanyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(5-bromofuran-2-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4S)-2-amino-4-(5-bromo-2-furyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C14H11BrN2O3 MolecularWeight: 335.15274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)Br)C(=O)C1

Isomeric SMILES

C1CC2=C([C@H](C(=C(O2)N)C#N)C3=CC=C(O3)Br)C(=O)C1

InChI

InChI=1S/C14H11BrN2O3/c15-11-5-4-10(19-11)12-7(6-16)14(17)20-9-3-1-2-8(18)13(9)12/h4-5,12H,1-3,17H2/t12-/m1/s1