3-bromanyl-2-(dimethoxymethyl)-2-methyl-4-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 3-bromanyl-2-(dimethoxymethyl)-2-methyl-4-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-bromo-2-(dimethoxymethyl)-4-hydroxy-2-methyl-chromane-6-carbonitrile CAS Name: 3-bromo-2-(dimethoxymethyl)-4-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-bromo-2-(dimethoxymethyl)-4-hydroxy-2-methyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-bromo-2-(dimethoxymethyl)-4-hydroxy-2-methyl-chroman-6-carbonitrile Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)O)Br)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)O)Br)C(OC)OC

InChI

InChI=1S/C14H16BrNO4/c1-14(13(18-2)19-3)12(15)11(17)9-6-8(7-16)4-5-10(9)20-14/h4-6,11-13,17H,1-3H3