2,2-dimethyl-3-oxidanyl-4-(5-oxidanylidene-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-(5-oxidanylidene-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(2-keto-4-phenoxy-3-pyrrolin-1-yl)-2,2-dimethyl-chroman-6-carbonitrile Formula: C22H20N2O4 MolecularWeight: 376.4052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC(=CC3=O)OC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC(=CC3=O)OC4=CC=CC=C4)O)C

InChI

InChI=1S/C22H20N2O4/c1-22(2)21(26)20(17-10-14(12-23)8-9-18(17)28-22)24-13-16(11-19(24)25)27-15-6-4-3-5-7-15/h3-11,20-21,26H,13H2,1-2H3