2-[(3S,4R)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one

Systemtic Name: 2-[(3S,4R)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one Openeye Name: 2-[(3S,4R)-3-hydroxy-2,2-dimethyl-chroman-4-yl]isoindolin-1-one CAS Name: 2-[(3S,4R)-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-3H-isoindol-1-one IUPAC Name: 2-[(3S,4R)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one Traditional Name: 2-[(3S,4R)-3-hydroxy-2,2-dimethyl-chroman-4-yl]isoindolin-1-one Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC=CC=C2O1)N3CC4=CC=CC=C4C3=O)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=CC=CC=C2O1)N3CC4=CC=CC=C4C3=O)O)C

InChI

InChI=1S/C19H19NO3/c1-19(2)17(21)16(14-9-5-6-10-15(14)23-19)20-11-12-7-3-4-8-13(12)18(20)22/h3-10,16-17,21H,11H2,1-2H3/t16-,17+/m1/s1