2,2-dimethyl-3-oxidanyl-3-(6-oxidanylidenepyrimidin-1-yl)-4H-chromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-3-(6-oxidanylidenepyrimidin-1-yl)-4H-chromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-3-(6-oxopyrimidin-1-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-3-(6-oxo-1-pyrimidinyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-3-(6-oxopyrimidin-1-yl)-4H-chromene-6-carbonitrile Traditional Name: 3-hydroxy-3-(6-ketopyrimidin-1-yl)-2,2-dimethyl-chroman-6-carbonitrile Formula: C16H15N3O3 MolecularWeight: 297.3086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=CC(=C2)C#N)(N3C=NC=CC3=O)O)C

Isomeric SMILES

CC1(C(CC2=C(O1)C=CC(=C2)C#N)(N3C=NC=CC3=O)O)C

InChI

InChI=1S/C16H15N3O3/c1-15(2)16(21,19-10-18-6-5-14(19)20)8-12-7-11(9-17)3-4-13(12)22-15/h3-7,10,21H,8H2,1-2H3