2-(methoxymethyl)-2-methyl-3-oxidanyl-4-(3-oxidanylidenecyclopenten-1-yl)oxy-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2-(methoxymethyl)-2-methyl-3-oxidanyl-4-(3-oxidanylidenecyclopenten-1-yl)oxy-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-(3-oxocyclopenten-1-yl)oxy-chromane-6-carbonitrile CAS Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-[(3-oxo-1-cyclopentenyl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-(3-oxocyclopenten-1-yl)oxy-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(3-ketocyclopenten-1-yl)oxy-2-(methoxymethyl)-2-methyl-chroman-6-carbonitrile Formula: C18H19NO5 MolecularWeight: 329.34716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=O)CC3)O)COC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=O)CC3)O)COC

InChI

InChI=1S/C18H19NO5/c1-18(10-22-2)17(21)16(23-13-5-4-12(20)8-13)14-7-11(9-19)3-6-15(14)24-18/h3,6-8,16-17,21H,4-5,10H2,1-2H3