2,2,3-trimethyl-3-oxidanyl-4-(3-oxidanylidenecyclohexen-1-yl)oxy-4H-chromene-6-carbonitrile

Systemtic Name: 2,2,3-trimethyl-3-oxidanyl-4-(3-oxidanylidenecyclohexen-1-yl)oxy-4H-chromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2,3-trimethyl-4-(3-oxocyclohexen-1-yl)oxy-chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2,3-trimethyl-4-[(3-oxo-1-cyclohexenyl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2,3-trimethyl-4-(3-oxocyclohexen-1-yl)oxy-4H-chromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(3-ketocyclohexen-1-yl)oxy-2,2,3-trimethyl-chroman-6-carbonitrile Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=O)CCC3)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=O)CCC3)(C)O)C

InChI

InChI=1S/C19H21NO4/c1-18(2)19(3,22)17(23-14-6-4-5-13(21)10-14)15-9-12(11-20)7-8-16(15)24-18/h7-10,17,22H,4-6H2,1-3H3