1-(2,2-dimethylpropyl)-7-methyl-1,4-dihydroisochromen-3-one

Systemtic Name: 1-(2,2-dimethylpropyl)-7-methyl-1,4-dihydroisochromen-3-one Openeye Name: 1-(2,2-dimethylpropyl)-7-methyl-isochroman-3-one CAS Name: 1-(2,2-dimethylpropyl)-7-methyl-3,4-dihydro-1H-2-benzopyran-3-one IUPAC Name: 1-(2,2-dimethylpropyl)-7-methyl-1,4-dihydroisochromen-3-one Traditional Name: 7-methyl-1-neopentyl-isochroman-3-one Formula: C15H20O2 MolecularWeight: 232.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(=O)OC2CC(C)(C)C)C=C1

Isomeric SMILES

CC1=CC2=C(CC(=O)OC2CC(C)(C)C)C=C1

InChI

InChI=1S/C15H20O2/c1-10-5-6-11-8-14(16)17-13(12(11)7-10)9-15(2,3)4/h5-7,13H,8-9H2,1-4H3