(4S)-4-(2-iodanylimidazol-1-yl)-3,3-dimethyl-4H-isochromen-1-one

Systemtic Name: (4S)-4-(2-iodanylimidazol-1-yl)-3,3-dimethyl-4H-isochromen-1-one Openeye Name: (4S)-4-(2-iodoimidazol-1-yl)-3,3-dimethyl-isochroman-1-one CAS Name: (4S)-4-(2-iodo-1-imidazolyl)-3,3-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (4S)-4-(2-iodoimidazol-1-yl)-3,3-dimethyl-4H-isochromen-1-one Traditional Name: (4S)-4-(2-iodoimidazol-1-yl)-3,3-dimethyl-isochroman-1-one Formula: C14H13IN2O2 MolecularWeight: 368.16969

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC=CC=C2C(=O)O1)N3C=CN=C3I)C

Isomeric SMILES

CC1([C@H](C2=CC=CC=C2C(=O)O1)N3C=CN=C3I)C

InChI

InChI=1S/C14H13IN2O2/c1-14(2)11(17-8-7-16-13(17)15)9-5-3-4-6-10(9)12(18)19-14/h3-8,11H,1-2H3/t11-/m0/s1