(4S)-2-azanyl-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile

Systemtic Name: (4S)-2-azanyl-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Openeye Name: (4S)-2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile CAS Name: (4S)-2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile IUPAC Name: (4S)-2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Traditional Name: (4S)-2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Formula: C18H16BrN3O3 MolecularWeight: 402.24194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(C(=C(O1)N)C#N)C2=CC3=C(C=C2Br)OCO3)C#N

Isomeric SMILES

CC(C)(C)C1=C([C@@H](C(=C(O1)N)C#N)C2=CC3=C(C=C2Br)OCO3)C#N

InChI

InChI=1S/C18H16BrN3O3/c1-18(2,3)16-10(6-20)15(11(7-21)17(22)25-16)9-4-13-14(5-12(9)19)24-8-23-13/h4-5,15H,8,22H2,1-3H3/t15-/m0/s1