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

Systemtic Name: (4S,7S)-2-azanyl-5-oxidanylidene-4,7-diphenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4S,7S)-2-amino-5-oxo-4,7-diphenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4S,7S)-2-amino-5-oxo-4,7-diphenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4S,7S)-2-amino-5-oxo-4,7-diphenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4S,7S)-2-amino-5-keto-4,7-diphenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C22H18N2O2 MolecularWeight: 342.39052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1OC(=C(C2C3=CC=CC=C3)C#N)N)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](CC(=O)C2=C1OC(=C([C@@H]2C3=CC=CC=C3)C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O2/c23-13-17-20(15-9-5-2-6-10-15)21-18(25)11-16(12-19(21)26-22(17)24)14-7-3-1-4-8-14/h1-10,16,20H,11-12,24H2/t16-,20+/m1/s1