4-[[2-(hydroxymethyl)-3-oxidanylidene-cyclopenten-1-yl]amino]-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbonitrile

Systemtic Name: 4-[[2-(hydroxymethyl)-3-oxidanylidene-cyclopenten-1-yl]amino]-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbonitrile Openeye Name: 3-hydroxy-4-[[2-(hydroxymethyl)-3-oxo-cyclopenten-1-yl]amino]-2,2,3-trimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-4-[[2-(hydroxymethyl)-3-oxo-1-cyclopentenyl]amino]-2,2,3-trimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-4-[[2-(hydroxymethyl)-3-oxocyclopenten-1-yl]amino]-2,2,3-trimethyl-4H-chromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[(3-keto-2-methylol-cyclopenten-1-yl)amino]-2,2,3-trimethyl-chroman-6-carbonitrile Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=C(C(=O)CC3)CO)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=C(C(=O)CC3)CO)(C)O)C

InChI

InChI=1S/C19H22N2O4/c1-18(2)19(3,24)17(21-14-5-6-15(23)13(14)10-22)12-8-11(9-20)4-7-16(12)25-18/h4,7-8,17,21-22,24H,5-6,10H2,1-3H3