2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepropyl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepropyl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-acetonyl-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-(2-oxopropyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-(2-oxopropyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-acetonyl-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

Isomeric SMILES

CC(=O)CC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

InChI

InChI=1S/C15H17NO3/c1-9(17)6-12-11-7-10(8-16)4-5-13(11)19-15(2,3)14(12)18/h4-5,7,12,14,18H,6H2,1-3H3