1-[(3S,4R)-4-azanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl]ethanone

Systemtic Name: 1-[(3S,4R)-4-azanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl]ethanone Openeye Name: 1-[(3S,4R)-4-amino-3-hydroxy-2,2-dimethyl-chroman-6-yl]ethanone CAS Name: 1-[(3S,4R)-4-amino-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl]ethanone IUPAC Name: 1-[(3S,4R)-4-amino-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]ethanone Traditional Name: 1-[(3S,4R)-4-amino-3-hydroxy-2,2-dimethyl-chroman-6-yl]ethanone Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2N)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC([C@H]([C@@H]2N)O)(C)C

InChI

InChI=1S/C13H17NO3/c1-7(15)8-4-5-10-9(6-8)11(14)12(16)13(2,3)17-10/h4-6,11-12,16H,14H2,1-3H3/t11-,12+/m1/s1