N-[(3R,4S)-6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-iodanyl-benzamide

Systemtic Name: N-[(3R,4S)-6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-iodanyl-benzamide Openeye Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-iodo-benzamide CAS Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-3-iodobenzamide IUPAC Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-iodobenzamide Traditional Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-iodo-benzamide Formula: C20H20INO4 MolecularWeight: 465.28157

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2NC(=O)C3=CC(=CC=C3)I)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC([C@@H]([C@H]2NC(=O)C3=CC(=CC=C3)I)O)(C)C

InChI

InChI=1S/C20H20INO4/c1-11(23)12-7-8-16-15(10-12)17(18(24)20(2,3)26-16)22-19(25)13-5-4-6-14(21)9-13/h4-10,17-18,24H,1-3H3,(H,22,25)/t17-,18+/m0/s1